Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLYCD | O95822 | 2/20 | 0.50 |
| ▸ | CCR1 | P32246 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 6/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5247130 | 0.95 | CCR1 (0.46) | MLYCDCCR1HPGDALDH1A1KDM4E | |
| SCHEMBL5246999 | 0.93 | HDAC1 (0.46) | CCR1ALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL5244318 | 0.92 | CCR1 (0.59) | MLYCDCCR1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL5249308 | 0.88 | RIPK1 (0.46) | CCR1HPGDALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL5246092 | 0.86 | EPHX2 (0.53) | CYP1A2CYP2C19LMNA | |
| SCHEMBL5248524 | 0.86 | LMNA (0.43) | MLYCDCCR1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL5244456 | 0.85 | LMNA (0.57) | ALDH1A1LMNAHDAC1 | |
| SCHEMBL5244694 | 0.85 | HPGD (0.48) | HPGDALDH1A1KDM4ECYP1A2CYP2C19 | |
| Trifluoroacetic Acid SCHEMBL5247370 | 0.85 | LMNA (0.48) | HPGDALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL5245295 | 0.85 | LMNA (0.44) | CCR1HPGDALDH1A1CYP1A2CYP2C19 |
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-1867331-A1 | TRIAZOLE DERIVATIVE AND THE USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2007-12-19 | — | — | EP | disclosed |
| EP-1763303-A1 | SUBSTITUTED PYRIDAZINE CARBOXAMIDES AND DERIVATIVES THEREOF | Bayer CropScience Aktiengesellschaft (DE) | 2007-03-21 | — | — | EP | disclosed |
| WO-2006000333-A1 | SUBSTITUTED PYRIDAZINE CARBOXAMIDES AND DERIVATIVES THEREOF | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2006-01-05 | — | — | WO | disclosed |