Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | FOS | P01100 | 1/20 | 0.47 |
| ▸ | JUN | P05412 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | MMP1 | P03956 | 2/20 | 0.45 |
| ▸ | MMP2 | P08253 | 2/20 | 0.45 |
| ▸ | MMP9 | P14780 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MAOA | P21397 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL22524298 | 0.82 | APP (0.47) | MAPTALDH1A1CA1RAB9ANPC1 | |
| SCHEMBL13825834 | 0.81 | TDP1 (0.52) | MAPTCYP2C9ALDH1A1MMP1MMP2 | |
| SCHEMBL22114228 | 0.78 | MAPT (0.53) | MAPTCYP3A4CYP2C9CYP2C19FOS | |
| SCHEMBL29242178 | 0.78 | CYP3A4 (0.55) | MAPTCYP3A4CYP2C9CYP2C19FOS | |
| SCHEMBL21727657 | 0.78 | CYP3A4 (0.55) | MAPTCYP3A4CYP2C9CYP2C19FOS | |
| SCHEMBL13392807 | 0.78 | RAB9A (0.60) | MAPTCYP3A4CYP2C19FOSJUN | |
| SCHEMBL14926305 | 0.78 | RAB9A (0.60) | MAPTCYP3A4CYP2C19FOSJUN | |
| SCHEMBL26018390 | 0.73 | KDM4E (0.33) | ALDH1A1HPGDRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL27335757 | 0.72 | CYP3A4 (0.39) | MAPTCYP3A4CYP2C9CYP2C19FOS | |
| SCHEMBL22060467 | 0.72 | RAB9A (0.70) | MAPTCYP3A4FOSJUNALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3321261-A1 | HEDGEHOG ANTAGONISTS HAVING ZINC BINDING MOIETIES | Curis, Inc. (US) | 2018-05-16 | — | — | EP | disclosed |