Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Hydrochloric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 7/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | POLB | P06746 | 4/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8515801 | 0.97 | MAPT (0.57) | MAPTTSHRALDH1A1POLBTDP1 | |
| Zinc Chloride SCHEMBL27740353 | 0.92 | MAPT (0.52) | MAPTTSHRALDH1A1POLBTDP1 | |
| SCHEMBL6678642 | 0.88 | MEN1 (0.49) | MAPTTSHRALDH1A1POLBTDP1 | |
| SCHEMBL1538922 | 0.85 | MAPT (0.56) | MAPTTSHRALDH1A1POLBTDP1 | |
| SCHEMBL18815092 | 0.84 | TSHR (0.54) | MAPTTSHRALDH1A1POLBTDP1 | |
| SCHEMBL11833302 | 0.84 | TSHR (0.50) | MAPTTSHRALDH1A1POLBTDP1 | |
| SCHEMBL11630094 | 0.83 | TSHR (0.46) | MAPTTSHRALDH1A1POLBTDP1 | |
| SCHEMBL11752365 | 0.82 | ALDH1A1 (0.49) | MAPTTSHRALDH1A1POLBTDP1 | |
| SCHEMBL11838661 | 0.79 | MEN1 (0.49) | MAPTTSHRALDH1A1POLBTDP1 | |
| SCHEMBL11747845 | 0.79 | MEN1 (0.49) | MAPTTSHRALDH1A1POLBTDP1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101270068-B | Method for preparing 2-nitryl-4-propylthioaniline | CHANGZHOU YABANG QIHUI PHARMACEUTICAL CHEMICAL ENGINEERING CO LTD | 2011-05-18 | — | — | CN | claimed |
| CN-101270091-B | Method for preparing albendazole | CHANGZHOU YABANG QIHUI PHARMACEUTICAL CHEMICAL ENGINEERING CO LTD | 2010-12-29 | — | — | CN | claimed |
| CN-101270091-A | Method for preparing albendazole | CHANGZHOU YABANG QIHUI PHARMAC (CN) | 2008-09-24 | — | — | CN | claimed |
| CN-101270068-A | Method for preparing 2-nitryl-4-propylthioaniline | CHANGZHOU YABANG QIHUI PHARMAC (CN) | 2008-09-24 | — | — | CN | claimed |
| CN-101270068-B | Method for preparing 2-nitryl-4-propylthioaniline | CHANGZHOU YABANG QIHUI PHARMACEUTICAL CHEMICAL ENGINEERING CO LTD | 2011-05-18 | — | — | CN | disclosed |
| CN-101270068-B | Method for preparing 2-nitryl-4-propylthioaniline | CHANGZHOU YABANG QIHUI PHARMACEUTICAL CHEMICAL ENGINEERING CO LTD | 2011-05-18 | — | — | CN | disclosed |
| CN-101270091-B | Method for preparing albendazole | CHANGZHOU YABANG QIHUI PHARMACEUTICAL CHEMICAL ENGINEERING CO LTD | 2010-12-29 | — | — | CN | disclosed |
| CN-101270091-A | Method for preparing albendazole | CHANGZHOU YABANG QIHUI PHARMAC (CN) | 2008-09-24 | — | — | CN | disclosed |
| CN-101270068-A | Method for preparing 2-nitryl-4-propylthioaniline | CHANGZHOU YABANG QIHUI PHARMAC (CN) | 2008-09-24 | — | — | CN | disclosed |
| CN-101270068-A | Method for preparing 2-nitryl-4-propylthioaniline | CHANGZHOU YABANG QIHUI PHARMAC (CN) | 2008-09-24 | — | — | CN | disclosed |