Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 7/20 | 0.51 |
| ▸ | AKR1C2 | P52895 | 6/20 | 0.51 |
| ▸ | CNR2 | P34972 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | PTGES | O14684 | 1/20 | 0.45 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.45 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.45 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4663300 | 0.92 | AKR1C3 (0.62) | AKR1C3AKR1C2CNR2PTGS2NPSR1 | |
| SCHEMBL8354130 | 0.92 | LMNA (0.54) | AKR1C3AKR1C2CNR2PTGS2NPSR1 | |
| SCHEMBL5554558 | 0.89 | AKR1C3 (0.47) | AKR1C3AKR1C2PTGS2PTGS1PPARG | |
| SCHEMBL4377895 | 0.89 | AKR1C3 (0.57) | AKR1C3AKR1C2PTGS2 | |
| SCHEMBL8360216 | 0.86 | CNR2 (0.46) | AKR1C3AKR1C2CNR2PTGS2AKR1C4 | |
| SCHEMBL5797505 | 0.76 | TRPV1 (0.40) | AKR1C3AKR1C2ALOX5PPARG | |
| SCHEMBL8358773 | 0.74 | CNR2 (0.44) | AKR1C3AKR1C2CNR2PTGS2NPSR1 | |
| SCHEMBL8354821 | 0.74 | RAB9A (0.47) | KMT2AALDH1A1MEN1ALOX5RAB9A | |
| SCHEMBL2075064 | 0.72 | ALDH1A1 (0.45) | NPSR1MAPTKMT2AALDH1A1KDM4E | |
| SCHEMBL2073237 | 0.72 | AKR1B1 (0.46) | KDM4EAKR1B1PTGDR2 |
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-5877202-A | Indole derivatives useful to treat estrogen-related neoplasms and disorders | AVENTISUB II INC. | 1999-03-02 | — | — | US | disclosed |