Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UGT2B7 | P16662 | 1/20 | 0.49 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | CDK4 | P11802 | 1/20 | 0.37 |
| ▸ | CCND1 | P24385 | 1/20 | 0.37 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CDC42 | P60953 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14288343 | 0.86 | CDK4 (0.41) | AKR1C3AKR1C2HDAC3HDAC4HDAC1 | |
| SCHEMBL20666274 | 0.83 | CDK4 (0.37) | AKR1C3AKR1C2HDAC3HDAC4HDAC1 | |
| SCHEMBL11827253 | 0.81 | AKR1C3 (0.61) | AKR1C3AKR1C2PTGS2PTGS1TSHR | |
| SCHEMBL23848110 | 0.81 | ABCB11 (0.43) | AKR1C3AKR1C2HDAC3HDAC4HDAC1 | |
| SCHEMBL11839847 | 0.80 | AKR1C3 (0.37) | AKR1C3AKR1C2HDAC3HDAC4HDAC1 | |
| SCHEMBL21164372 | 0.79 | BCL2L11 (0.40) | AKR1C3AKR1C2HDAC3HDAC4HDAC1 | |
| SCHEMBL30134301 | 0.78 | OGA (0.41) | UGT2B7CYP11B1CYP11B2CYP1A2LMNA | |
| SCHEMBL30133952 | 0.78 | OGA (0.41) | UGT2B7CYP11B1CYP11B2CYP1A2LMNA | |
| SCHEMBL25804159 | 0.78 | OGA (0.41) | UGT2B7CYP11B1CYP11B2CYP1A2LMNA | |
| SCHEMBL31201745 | 0.77 | CYP1A2 (0.55) | UGT2B7AKR1C3AKR1C2CYP1A2SCN9A |
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-3991061-A | Azanaphthaleneacetic acid derivatives | G. D. SEARLE & CO. (US) | 1976-11-09 | — | — | US | disclosed |