Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 5/20 | 0.47 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.38 |
| ▸ | PPOX | P50336 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | CCR6 | P51684 | 1/20 | 0.37 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.37 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4076129 | 0.81 | CCR1 (0.50) | CCR1ALDH1A1MAPTLMNA | |
| SCHEMBL3227831 | 0.77 | CCR1 (0.49) | CCR1MALT1PPOXMAPTHPGD | |
| SCHEMBL3227912 | 0.76 | CCR1 (0.50) | CCR1MALT1PPOXALDH1A1MAPT | |
| SCHEMBL3225808 | 0.75 | POLB (0.59) | ALDH1A1MAPTMAPK1LMNASMN1; SMN2 | |
| SCHEMBL3223360 | 0.72 | ALDH1A1 (0.47) | CCR1PPOXALDH1A1MAPTCYP1A2 | |
| SCHEMBL3224081 | 0.72 | MALT1 (0.48) | CCR1MALT1ALDH1A1TSHR | |
| SCHEMBL2874775 | 0.70 | HTR3A (0.60) | MAPTCYP2C19LMNAHTR2CHTR6 | |
| SCHEMBL5048385 | 0.70 | CCR1 (0.41) | CCR1ALDH1A1MAPTMAPK1LMNA | |
| Hydrochloric Acid SCHEMBL5051976 | 0.69 | CCR1 (0.41) | CCR1ALDH1A1MAPTMAPK1LMNA | |
| Hydrochloric Acid SCHEMBL2870719 | 0.69 | HTR3A (0.59) | MAPTCYP2C19LMNAHTR2CHTR6 |
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-2084146-A1 | CYCLIC DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | Brystol-Myers Squibb Company (US) | 2009-08-05 | — | — | EP | disclosed |
| WO-2008042925-A1 | CYCLIC DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-04-10 | — | — | WO | disclosed |