Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | OPRL1 | P41146 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22050088 | 0.91 | OPRM1 (0.60) | OPRM1CYP3A4HSD17B10SIGMAR1CYP2D6 | |
| SCHEMBL28123157 | 0.86 | CYP3A4 (0.45) | OPRM1CYP3A4HSD17B10SIGMAR1CYP2D6 | |
| SCHEMBL23285142 | 0.85 | OPRM1 (0.50) | OPRM1CYP3A4HSD17B10SIGMAR1CYP2D6 | |
| SCHEMBL2604321 | 0.79 | OPRM1 (0.56) | OPRM1CYP3A4HSD17B10SIGMAR1TSHR | |
| SCHEMBL2275141 | 0.78 | OPRM1 (0.57) | OPRM1CYP3A4HSD17B10SIGMAR1CYP2D6 | |
| SCHEMBL23089517 | 0.78 | CYP2D6 (0.46) | OPRM1CYP3A4SIGMAR1CYP2D6TSHR | |
| SCHEMBL12406526 | 0.76 | CYP3A4 (0.50) | CYP3A4HSD17B10SIGMAR1CYP2D6TSHR | |
| SCHEMBL17714545 | 0.75 | OPRM1 (0.51) | OPRM1CYP3A4HSD17B10SIGMAR1TSHR | |
| SCHEMBL3893581 | 0.75 | OPRM1 (0.57) | OPRM1CYP3A4HSD17B10SIGMAR1CYP2D6 | |
| SCHEMBL15325219 | 0.75 | OPRM1 (0.57) | OPRM1CYP3A4HSD17B10SIGMAR1CYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5453422-A | Animal growth promoters | BAYER AKTIENGESELLSCHAFT (DE) | 1995-09-26 | — | — | US | disclosed |
| US-5284842-A | Active against gramnegative bacteria | BAYER AKTIENGESELLSCHAFT (DE) | 1994-02-08 | — | — | US | disclosed |
| US-5173484-A | Animal growth regulators | BAYER AKTIENGESELLSCHAFT (DE) | 1992-12-22 | — | — | US | disclosed |