Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | IDH1 | O75874 | 1/20 | 0.31 |
| ▸ | CFTR | P13569 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8554861 | 0.85 | CYP3A4 (0.49) | CYP3A4CYP2C9CYP2C19HSP90AA1 | |
| SCHEMBL8554392 | 0.84 | CYP3A4 (0.38) | HTTKMT2ASMN1; SMN2CYP3A4CYP2C9 | |
| SCHEMBL8554074 | 0.76 | CYP3A4 (0.53) | CYP3A4CYP2C9CYP2C19HSP90AA1 | |
| SCHEMBL8554860 | 0.74 | CYP3A4 (0.47) | CYP3A4CYP2C9CYP2C19HSP90AA1 | |
| SCHEMBL8554855 | 0.74 | CYP3A4 (0.47) | CYP3A4CYP2C9CYP2C19HSP90AA1 | |
| SCHEMBL8556550 | 0.74 | HSP90AA1 (0.39) | KMT2AMAPTCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL8554388 | 0.73 | CYP3A4 (0.39) | HTTKMT2ASMN1; SMN2CYP3A4CYP2C9 | |
| SCHEMBL8554382 | 0.73 | CYP3A4 (0.39) | HTTKMT2ASMN1; SMN2CYP3A4CYP2C9 | |
| SCHEMBL8554163 | 0.71 | CYP3A4 (0.54) | CYP3A4CYP2C9CYP2C19HSP90AA1 | |
| SCHEMBL8553352 | 0.69 | CYP3A4 (0.47) | CYP3A4CYP2C9CYP2C19HSP90AA1 |
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-5646294-A | FUNGICIDES | J. URIACH & CIA. S.A. (ES) | 1997-07-08 | — | — | US | disclosed |