Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 3/20 | 0.51 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.43 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | MMP13 | P45452 | 1/20 | 0.40 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.40 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL5250048 | 0.92 | EPHX2 (0.46) | CCR1RAB9AMEN1KMT2A | |
| SCHEMBL5246087 | 0.91 | CCR1 (0.47) | CCR1ABCB1PTGER1MEN1KMT2A | |
| SCHEMBL5248465 | 0.91 | CCR1 (0.46) | CCR1ABCB1MEN1KMT2AHTT | |
| SCHEMBL5245586 | 0.91 | CCR1 (0.46) | CCR1MEN1KMT2APTGER4MAPT | |
| SCHEMBL5247796 | 0.90 | CCR1 (0.45) | CCR1ABCB1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL5249014 | 0.90 | CCR1 (0.45) | CCR1ABCB1MEN1KMT2APTGER4 | |
| SCHEMBL5244716 | 0.90 | CCR1 (0.57) | CCR1CYP1A2CYP2D6CYP2C19RAB9A | |
| SCHEMBL5244866 | 0.89 | CCR1 (0.44) | CCR1ABCB1POLBMEN1KMT2A | |
| SCHEMBL5247606 | 0.89 | MAPK14 (0.54) | CCR1ABCB1 | |
| SCHEMBL5246577 | 0.89 | SMN1; SMN2 (0.47) | CCR1CYP2D6CYP2C9POLBPTGER4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1867331-A1 | TRIAZOLE DERIVATIVE AND THE USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2007-12-19 | — | — | EP | disclosed |