Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | POLA1 | P09884 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4911889 | 0.80 | OPRM1 (0.42) | OPRM1CYP2C19SIGMAR1POLA1OPRK1 | |
| SCHEMBL11457213 | 0.79 | OPRM1 (0.39) | OPRM1CYP2C19RAB9AOPRK1CYP2C9 | |
| SCHEMBL6583622 | 0.75 | POLA1 (0.46) | CYP2C19SIGMAR1POLA1RAB9ACYP2C9 | |
| SCHEMBL10998258 | 0.74 | KDM1A (0.46) | OPRM1CYP2C19ALDH1A1LMNAGAA | |
| SCHEMBL28735232 | 0.73 | SIGMAR1 (0.45) | CYP2C19SIGMAR1POLA1CYP2C9TSHR | |
| SCHEMBL14005909 | 0.73 | OPRM1 (0.36) | OPRM1SIGMAR1POLA1OPRK1ALDH1A1 | |
| SCHEMBL11458609 | 0.72 | SIGMAR1 (0.40) | CYP2C19SIGMAR1POLA1CYP2C9TSHR | |
| SCHEMBL11459392 | 0.71 | BRD4 (0.42) | OPRM1CYP2C19SIGMAR1POLA1RAB9A | |
| SCHEMBL3749240 | 0.70 | DGAT1 (0.49) | OPRM1SIGMAR1POLA1OPRK1TSHR | |
| SCHEMBL12961189 | 0.70 | SIGMAR1 (0.41) | OPRM1CYP2C19SIGMAR1POLA1CYP2C9 |
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-4234731-A | BROMINATION AND SALT FORMATION OF BENZ(E)INDOLINES; HYDROLYSIS WITH A BICARBONATE; RING EXPANSION AND REARRANGEMENT | BRISTOL-MYERS COMPANY (US) | 1980-11-18 | — | — | US | disclosed |
| US-4150032-A | ANALGESIC, ANTITUSSIVE | BRISTOL-MYERS COMPANY (US) | 1979-04-17 | — | — | US | disclosed |