Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27553271 | 0.81 | CA2 (0.37) | CA2HTTPARP1 | |
| SCHEMBL3636160 | 0.78 | CA2 (0.44) | CA2ALDH1A1HPGDHTTPARP1 | |
| SCHEMBL26614361 | 0.76 | CA2 (0.43) | CA2HTTPARP1 | |
| SCHEMBL11404710 | 0.75 | CA2 (0.41) | CA2ALDH1A1ALOX5HTTHRH3 | |
| SCHEMBL9618689 | 0.74 | HPGD (0.43) | CA2ALDH1A1HPGDTDP1ALOX5 | |
| SCHEMBL1689230 | 0.73 | CA2 (0.42) | CA2ALDH1A1ALOX5HTTLMNA | |
| SCHEMBL27816269 | 0.72 | GRM2 (0.44) | CA2ALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL20544792 | 0.72 | CA2 (0.43) | CA2HTT | |
| SCHEMBL20787076 | 0.71 | CFTR (0.33) | ALDH1A1USP2HPGDTDP1PPARG | |
| SCHEMBL15111194 | 0.71 | GRM2 (0.45) | ALDH1A1HPGDMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-112770813-A | Methods of treating cancer with substituted pyrrole and pyrazole compounds and diagnosing cancer sensitive to treatment with substituted pyrrole and pyrazole compounds | 班塔姆制药有限责任公司 | 2021-05-07 | — | — | CN | disclosed |