Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHBP | P24387 | 1/20 | 0.42 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.39 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Chlorobenzene SCHEMBL28129348 | 0.81 | TSHR (0.42) | PKMMEN1KMT2ALMNAALDH1A1 | |
| Isopropylbenzene SCHEMBL27970219 | 0.80 | ADRA2A (0.48) | PKMAOC3TAAR1LMNAALDH1A1 | |
| Chlorobenzene SCHEMBL28128879 | 0.80 | TSHR (0.41) | KMT2ATAAR1LMNAALDH1A1MAPT | |
| Fluorobenzene SCHEMBL28128810 | 0.78 | GAA (0.37) | PKMMEN1KMT2AALDH1A1L3MBTL1 | |
| O-Xylene SCHEMBL29074374 | 0.77 | TSHR (0.42) | PKMTAAR1ALDH1A1L3MBTL1MAPT | |
| Fluorobenzene SCHEMBL28840059 | 0.76 | IDO1 (0.38) | PKMMEN1KMT2AALDH1A1L3MBTL1 | |
| SCHEMBL4018230 | 0.76 | AOC3 (0.58) | AOC3BCAT2TAAR1 | |
| SCHEMBL17198959 | 0.76 | AOC3 (0.58) | AOC3BCAT2TAAR1 | |
| O-Xylene SCHEMBL29074411 | 0.76 | TSHR (0.40) | PKMKMT2AALDH1A1L3MBTL1MAPT | |
| Hydrochloric Acid SCHEMBL28129394 | 0.75 | TAAR1 (0.56) | AOC3BCAT2TAAR1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106458868-A | Guanidine compounds and uses thereof | 伊谬诺米特医疗有限公司 | 2017-02-22 | — | — | CN | claimed |
| CN-106458868-A | Guanidine compounds and uses thereof | 伊谬诺米特医疗有限公司 | 2017-02-22 | — | — | CN | disclosed |