Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 2/20 | 0.39 |
| ▸ | AHR | P35869 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 4/20 | 0.38 |
| ▸ | MAOB | P27338 | 4/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6205403 | 0.86 | CHRM5 (0.50) | CYP3A4CYP1A2NPC1RAB9ATDP1 | |
| SCHEMBL7321393 | 0.77 | KDM4E (0.55) | KDM4EALDH1A1SMN1; SMN2TP53CYP3A4 | |
| SCHEMBL6204838 | 0.76 | ALDH1A1 (0.47) | KDM4EALDH1A1SMN1; SMN2MAPK1TDP1 | |
| SCHEMBL6204213 | 0.76 | RELA (0.45) | TP53CYP1A2CYP2D6CYP2C19RELA | |
| SCHEMBL493931 | 0.75 | MAOA (0.62) | KDM4EALDH1A1SMN1; SMN2TP53CYP3A4 | |
| SCHEMBL29432706 | 0.75 | MAOA (0.62) | KDM4EALDH1A1SMN1; SMN2TP53CYP3A4 | |
| SCHEMBL5247739 | 0.75 | KDM4E (0.60) | KDM4EALDH1A1SMN1; SMN2TP53CYP3A4 | |
| SCHEMBL10071508 | 0.74 | TDP1 (0.41) | KDM4EALDH1A1SMN1; SMN2TP53CYP3A4 | |
| SCHEMBL10071525 | 0.74 | TDP1 (0.41) | KDM4EALDH1A1SMN1; SMN2TP53CYP3A4 | |
| Benzene SCHEMBL27795602 | 0.74 | MAOA (0.65) | KDM4EALDH1A1SMN1; SMN2TP53CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1506175-A1 | N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDGF RECEPTOR INHIBITORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2005-02-16 | — | — | EP | disclosed |
| WO-2003097609-A1 | N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDFG RECEPTOR INHIBITORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2003-11-27 | — | — | WO | disclosed |