Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 6/20 | 0.71 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.64 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.61 |
| ▸ | HTT | P42858 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.55 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.54 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | NSD2 | O96028 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL1415906 | 0.98 | SRD5A2 (0.73) | SRD5A2AKR1B1ABCC4LMNAGAA | |
| SCHEMBL16091058 | 0.92 | LMNA (0.74) | SRD5A2AKR1B1ABCC4LMNAGAA | |
| Benzophenone SCHEMBL8820654 | 0.91 | AKR1B1 (0.77) | SRD5A2AKR1B1ABCC4LMNAGAA | |
| SCHEMBL29163965 | 0.83 | SRD5A2 (0.79) | SRD5A2GAAHTTALDH1A1ATM | |
| SCHEMBL3468559 | 0.83 | CA2 (0.79) | SRD5A2AKR1B1ABCC4LMNAGAA | |
| SCHEMBL6238323 | 0.83 | ALDH1A1 (0.73) | SRD5A2GAAHTTALDH1A1FFAR1 | |
| Methane SCHEMBL11262863 | 0.82 | ATM (0.61) | SRD5A2AKR1B1ALDH1A1ATMTDP1 | |
| Phenylacetic Acid SCHEMBL2208559 | 0.82 | AKR1B1 (0.94) | AKR1B1ABCC4LMNAGAATSHR | |
| SCHEMBL11135171 | 0.82 | SRD5A2 (0.59) | SRD5A2AKR1B1ABCC4LMNAGAA | |
| SCHEMBL11054849 | 0.82 | ALDH1A1 (0.56) | SRD5A2LMNAHTTALDH1A1ATM |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4064132-A | ANTIINFLAMMATORY AGENTS | JANSSEN PHARMACEUTICA N.V. (BE) | 1977-12-20 | — | — | US | disclosed |
| US-4060528-A | ANTIINFLAMMATORY | JANSSEN PHARMACEUTICA N.V. (BE) | 1977-11-29 | — | — | US | disclosed |
| US-4035376-A | ESTERS, AMIDES, HYDROXAMIC ACIDS, ANTIINFLAMMATORY | JANSSEN PHARMACEUTICA N.V. (BE) | 1977-07-12 | — | — | US | disclosed |