Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | POLA1 | P09884 | 2/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.36 |
| ▸ | CXCR5 | P32302 | 1/20 | 0.36 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 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 | |
|---|---|---|---|---|
| SCHEMBL11457214 | 0.79 | AKR1C3 (0.39) | POLA1AKR1C3AKR1C2AKR1C1PTGS1 | |
| SCHEMBL6583622 | 0.78 | POLA1 (0.46) | SIGMAR1POLA1CXCR5CYP2C19CYP2C9 | |
| SCHEMBL28735232 | 0.73 | SIGMAR1 (0.45) | SIGMAR1POLA1CYP2C19CYP2C9TSHR | |
| SCHEMBL11458608 | 0.72 | OPRM1 (0.39) | SIGMAR1POLA1CYP2C19CYP2C9TSHR | |
| SCHEMBL11459393 | 0.71 | AKR1C3 (0.46) | POLA1AKR1C3AKR1C2AKR1C1PTGS1 | |
| SCHEMBL30067572 | 0.70 | KDM1A (0.41) | KDM1A | |
| SCHEMBL16388051 | 0.70 | KDM1A (0.45) | SIGMAR1POLA1CYP2C19CYP2C9TSHR | |
| SCHEMBL18487244 | 0.69 | POLA1 (0.46) | SIGMAR1POLA1AKR1C3AKR1C2PTGS1 | |
| SCHEMBL6580889 | 0.68 | POLA1 (0.55) | SIGMAR1POLA1CYP2C19CYP2C9TSHR | |
| SCHEMBL5396757 | 0.68 | POLA1 (0.52) | SIGMAR1POLA1CXCR5KDM1A |
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 |