Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | GPR139 | Q6DWJ6 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | BUB1 | O43683 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9858075 | 0.92 | CYP2C19 (0.48) | CYP2C19ALDH1A1KDM4ELMNASMN1; SMN2 | |
| SCHEMBL9857894 | 0.88 | ALDH1A1 (0.43) | CYP2C19ALDH1A1KDM4ELMNASMN1; SMN2 | |
| SCHEMBL9858043 | 0.87 | ALDH1A1 (0.37) | TP53GPR139ALDH1A1MAPK1KMT2A | |
| SCHEMBL9858303 | 0.80 | PTGER1 (0.41) | TP53ALDH1A1KDM4EKMT2A | |
| SCHEMBL9857981 | 0.80 | HTT (0.39) | TP53ALDH1A1ROCK2KMT2A | |
| SCHEMBL11117769 | 0.78 | ALDH1A1 (0.48) | TP53ALDH1A1LMNASMN1; SMN2MAPK1 | |
| SCHEMBL11010308 | 0.74 | CA5A (0.41) | CA5ATP53ALDH1A1KDM4EBUB1 | |
| SCHEMBL10670780 | 0.73 | TP53 (0.58) | CA5ATP53ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL17283078 | 0.72 | TP53 (0.49) | CA5ATP53ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL9714241 | 0.68 | RIPK1 (0.43) | CA5ACYP2C19ALDH1A1KDM4ELMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0199262-B1 | FLUORINATED BENZYL TRIAZOLE COMPOUNDS | CIBA-GEIGY AG (CH) | 1991-02-27 | — | — | EP | disclosed |