Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHBP | P24387 | 1/20 | 0.52 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | MTOR | P42345 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | VCP | P55072 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13904548 | 0.82 | NPC1 (0.55) | CRHBPCRHR2CYP3A4NPC1MTOR | |
| SCHEMBL6023661 | 0.81 | NPC1 (0.51) | CRHBPCRHR2CYP3A4NPC1MTOR | |
| SCHEMBL6023664 | 0.81 | NPC1 (0.51) | CRHBPCRHR2CYP3A4NPC1MTOR | |
| SCHEMBL10063347 | 0.81 | NPC1 (0.54) | CRHBPCRHR2CYP3A4NPC1MTOR | |
| SCHEMBL1245813 | 0.79 | NPC1 (0.57) | CRHBPCRHR2CYP3A4NPC1MTOR | |
| SCHEMBL1245814 | 0.79 | NPC1 (0.57) | CRHBPCRHR2CYP3A4NPC1MTOR | |
| SCHEMBL2113455 | 0.79 | NPC1 (0.57) | CRHBPCRHR2CYP3A4NPC1MTOR | |
| SCHEMBL11072474 | 0.78 | GAA (0.52) | NPC1RAB9AVCPHPGDCYP1A2 | |
| SCHEMBL11080235 | 0.77 | FBP1 (0.50) | CYP3A4NPC1RAB9AHPGDCYP1A2 | |
| SCHEMBL11076864 | 0.77 | FBP1 (0.49) | KDM4EALDH1A1KMT2APKMMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4469703-A | FUNGICIDES | EGYT GYOGYSZERVEGYESZETI GYAR (HU) | 1984-09-04 | — | — | US | disclosed |