Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | SYK | P43405 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21225836 | 0.81 | ALDH1A1 (0.59) | RAB9AKDM4EGPR119ALDH1A1HPGD | |
| SCHEMBL27106086 | 0.81 | CYP3A4 (0.39) | CYP3A4CYP2C19RAB9ANPC1KDM4E | |
| SCHEMBL26622013 | 0.77 | KDM4E (0.52) | RAB9ANPC1KDM4ESYKALDH1A1 | |
| SCHEMBL20688897 | 0.76 | KDM4E (0.43) | RAB9ANPC1KDM4ESYKALDH1A1 | |
| SCHEMBL16760289 | 0.75 | CRHBP (0.40) | CYP3A4CYP2C19RAB9ANPC1KDM4E | |
| SCHEMBL31344227 | 0.75 | HTT (0.35) | CYP2C19RAB9ANPC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL7389778 | 0.75 | ALDH1A1 (0.49) | RAB9ANPC1KDM4EALDH1A1HPGD | |
| SCHEMBL15052607 | 0.74 | ALDH1A1 (0.38) | CYP2C19SYKALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL12265083 | 0.74 | CYP3A4 (0.46) | CYP3A4CYP2C19RAB9ANPC1KDM4E | |
| SCHEMBL29624993 | 0.73 | SYK (0.34) | KDM4ESYKALDH1A1HPGDKMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1891047-A4 | 1-METHYL-1H-PYRAZOLE-4-CARBOXAMIDES USEFUL AS CANCER CHEMOTHERAPEUTIC AGENTS | BAYER HEALTHCARE AG (DE) | 2008-07-09 | — | — | EP | disclosed |
| EP-1891047-A2 | 1-METHYL-1H-PYRAZOLE-4-CARBOXAMIDES USEFUL AS CANCER CHEMOTHERAPEUTIC AGENTS | Bayer HealthCare AG (DE) | 2008-02-27 | — | — | EP | disclosed |
| WO-2006133006-A2 | 1-METHYL-1H-PYRAZOLE-4-CARBOXAMIDES USEFUL AS CANCER CHEMOTHERAPEUTIC AGENTS | BAYER HEALTHCARE AG (DE) | 2006-12-14 | — | — | WO | disclosed |