Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 2/20 | 0.46 |
| ▸ | MGLL | Q99685 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.41 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SGPL1 | O95470 | 2/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.40 |
| ▸ | PPARD | Q03181 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.38 |
| ▸ | ACR | P10323 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.38 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.38 |
| ▸ | SRD5A2 | P31213 | 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 | |
|---|---|---|---|---|
| SCHEMBL11075730 | 0.97 | MCHR1 (0.46) | MCHR1MGLLCYP3A4CYP2C8S1PR3 | |
| SCHEMBL11209612 | 0.96 | CYP3A4 (0.46) | MCHR1MGLLCYP3A4CYP2C8S1PR3 | |
| SCHEMBL11211358 | 0.96 | CYP3A4 (0.46) | MCHR1MGLLCYP3A4CYP2C8S1PR3 | |
| SCHEMBL11209532 | 0.96 | CYP3A4 (0.46) | MCHR1MGLLCYP3A4CYP2C8S1PR3 | |
| SCHEMBL11214851 | 0.94 | MCHR1 (0.48) | MCHR1MGLLCYP3A4CYP2C8S1PR3 | |
| SCHEMBL11209164 | 0.90 | MCHR1 (0.49) | MCHR1MGLLCYP19A1PPARDPPARA | |
| SCHEMBL11206793 | 0.86 | MCHR1 (0.48) | MCHR1CYP3A4CYP2C8S1PR3CYP2D6 | |
| SCHEMBL14525798 | 0.85 | MCHR1 (0.42) | MCHR1CYP3A4CYP2C8S1PR3CYP2D6 | |
| SCHEMBL11213381 | 0.85 | MCHR1 (0.47) | MCHR1CYP3A4CYP2C8S1PR3CYP2D6 | |
| SCHEMBL11207970 | 0.85 | CYP3A4 (0.48) | MCHR1CYP3A4CYP2C8S1PR3CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-4391731-A | Hydrogenated naphthalenes | HOFFMANN-LA ROCHE INC. (US) | 1983-07-05 | — | — | US | disclosed |
| EP-0047817-A2 | Hydrogenated naphthalines, their preparation and application, and mixtures containing such naphthalines | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1982-03-24 | — | — | EP | disclosed |