Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | CASP6 | P55212 | 1/20 | 0.45 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 2/20 | 0.40 |
| ▸ | NOS2 | P35228 | 6/20 | 0.40 |
| ▸ | NOS3 | P29474 | 4/20 | 0.40 |
| ▸ | NOS1 | P29475 | 4/20 | 0.40 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4868592 | 0.84 | CTSK (0.43) | LMNAHTTSMN1; SMN2TAS1R3TAS1R1 | |
| SCHEMBL4869837 | 0.79 | CTSL (0.44) | ALDH1A1CYP2C9CYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL4868064 | 0.78 | CTSK (0.47) | ALDH1A1CASP1CASP3CASP7CASP6 | |
| SCHEMBL4869933 | 0.78 | KMT2A (0.41) | ALDH1A1SMN1; SMN2MMP1POLBMMP2 | |
| SCHEMBL4866588 | 0.78 | CTSS (0.48) | CASP1CASP3CASP7CASP6CASP8 | |
| SCHEMBL14158062 | 0.75 | KMT2A (0.51) | ALDH1A1CYP3A4CYP2C9CYP1A2MAPK1 | |
| SCHEMBL5493122 | 0.75 | CASP1 (0.48) | ALDH1A1CYP3A4CYP2C9CYP1A2MAPK1 | |
| SCHEMBL14597548 | 0.75 | CASP1 (0.48) | ALDH1A1CYP3A4CYP2C9CYP1A2MAPK1 | |
| SCHEMBL4868071 | 0.74 | CASP3 (0.38) | CASP3 | |
| SCHEMBL4912638 | 0.72 | MEN1 (0.52) | ALDH1A1CASP1CASP3CASP7CASP6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7390804-B2 | N-containing five-membered ring compounds and pharmaceutical agents comprising the same as active ingredient | ONO PHARMACEUTICAL CO., LTD. (JP) | 2008-06-24 | — | — | US | disclosed |
| US-7390804-B2 | N-containing five-membered ring compounds and pharmaceutical agents comprising the same as active ingredient | ONO PHARMACEUTICAL CO., LTD. (JP) | 2008-06-24 | — | — | US | disclosed |