Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 17/20 | 0.59 |
| ▸ | AKR1C2 | P52895 | 17/20 | 0.59 |
| ▸ | AKR1C4 | P17516 | 2/20 | 0.52 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | FABP2 | P12104 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2116956 | 0.87 | AKR1C3 (0.56) | AKR1C3AKR1C2AKR1C4AKR1C1PTGS1 | |
| SCHEMBL30428628 | 0.85 | AKR1C3 (0.64) | AKR1C3AKR1C2AKR1C4AKR1C1PTGS1 | |
| SCHEMBL1567845 | 0.82 | AKR1C3 (0.63) | AKR1C3AKR1C2AKR1C4AKR1C1PTGS1 | |
| SCHEMBL1590732 | 0.81 | AKR1C3 (0.72) | AKR1C3AKR1C2AKR1C4AKR1C1PTGS1 | |
| SCHEMBL29009770 | 0.81 | AKR1C3 (0.59) | AKR1C3AKR1C2AKR1C4AKR1C1PTGS1 | |
| SCHEMBL1002973 | 0.79 | AKR1C3 (0.50) | AKR1C3AKR1C2AKR1C4AKR1C1PTGS1 | |
| SCHEMBL30868019 | 0.79 | GAA (0.47) | AKR1C3AKR1C2PTGS1TSHRLMNA | |
| SCHEMBL397079 | 0.79 | GAA (0.47) | AKR1C3AKR1C2PTGS1TSHRLMNA | |
| SCHEMBL298387 | 0.79 | AKR1C3 (0.68) | AKR1C3AKR1C2AKR1C4AKR1C1PTGS1 | |
| SCHEMBL112764 | 0.78 | AKR1C3 (0.59) | AKR1C3AKR1C2AKR1C4AKR1C1PTGS1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4337264-A | ANALGESICS, ANTIINFLAMMATORY AGENTS AND FUNGICIDES | CIBA-GEIGY CORPORATION (US) | 1982-06-29 | — | — | US | disclosed |
| US-4316850-A | ANTINFLAMMATORY AGENTS | CIBA-GEIGY CORPORATION (US) | 1982-02-23 | — | — | US | disclosed |
| US-4264619-A | Tertiary aminoacids | CIBA-GEIGY CORPORATION (US) | 1981-04-28 | — | — | US | disclosed |
| US-4163788-A | ANTIINFLAMMATORY | CIBA-GEIGY CORPORATION (US) | 1979-08-07 | — | — | US | disclosed |
| US-4126691-A | ANTIINFLAMMATORY | CIBA-GEIGY CORPORATION (US) | 1978-11-21 | — | — | US | disclosed |
| US-3993763-A | ALPHA-(CYCLIC TERTIARY AMINO-PHENYL)-ALIPHATIC ACIDS | CIBA-GEIGY CORPORATION (US) | 1976-11-23 | — | — | US | disclosed |
| US-3936467-A | ANTIINFLAMMATORY | CIBA-GEIGY CORPORATION (US) | 1976-02-03 | — | — | US | disclosed |