Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. 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 | |
|---|---|---|---|---|
| ▸ | ACHE known ✓ | P22303 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | ELANE | P08246 | 2/20 | 0.33 |
| ▸ | BCHE | P06276 | 2/20 | 0.33 |
| ▸ | TGM2 | P21980 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 2/20 | 0.31 |
| ▸ | MMP2 | P08253 | 1/20 | 0.31 |
| ▸ | MMP14 | P50281 | 1/20 | 0.31 |
| ▸ | MMP1 | P03956 | 1/20 | 0.31 |
| ▸ | MMP13 | P45452 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | LMNA | P02545 | 2/20 | 0.30 |
| ▸ | HTT | P42858 | 2/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9487566 | 0.90 | THRB (0.45) | THRBMAPTPOLBPKMELANE | |
| SCHEMBL246091 | 0.87 | THRB (0.54) | THRBMAPTPOLBPKMELANE | |
| Trifluoromethanesulfonic Acid SCHEMBL30925711 | 0.86 | THRB (0.42) | THRBMAPTPOLBPKMELANE | |
| SCHEMBL9619082 | 0.84 | MAPT (0.40) | MAPTPOLBPKMELANEBCHE | |
| SCHEMBL9646952 | 0.83 | MAPT (0.54) | MAPTPOLBPKMELANEALDH1A1 | |
| SCHEMBL5576290 | 0.81 | ELANE (0.46) | MAPTPOLBPKMELANEBCHE | |
| SCHEMBL7902339 | 0.80 | MAPT (0.43) | MAPTLMNAHSD17B10KMT2AMAPK1 | |
| SCHEMBL11449253 | 0.79 | RAB9A (0.56) | PKMBCHEACHEALDH1A1LMNA | |
| SCHEMBL7901795 | 0.78 | ALDH1A1 (0.45) | MAPTALDH1A1LMNAHTTHSD17B10 | |
| SCHEMBL9647013 | 0.77 | KMT2A (0.49) | MAPTPKMALDH1A1KMT2ATSHR |
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 |
|---|---|---|---|---|---|---|---|
| JP-5032618-A | — | — | None | — | — | JP | disclosed |
| JP-H0532618-A | NEW ACRYLATE COMPOUND | SANSHIN CHEM IND CO LTD | 1993-02-09 | — | — | JP | disclosed |