Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 3/20 | 0.44 |
| ▸ | CCR2 | P41597 | 7/20 | 0.39 |
| ▸ | USP2 | O75604 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4797150 | 0.78 | TACR1 (0.59) | TACR1CCR2CYP3A4 | |
| SCHEMBL4732647 | 0.76 | CCR2 (0.43) | TACR1CCR2 | |
| Trifluoroacetic Acid SCHEMBL3038763 | 0.75 | TACR1 (0.58) | TACR1CCR2CYP3A4 | |
| SCHEMBL4731354 | 0.74 | TACR1 (0.40) | TACR1CCR2USP2ALDH1A1CYP2D6 | |
| SCHEMBL3033014 | 0.69 | CCR2 (0.49) | TACR1CCR2USP2ALDH1A1CYP2D6 | |
| SCHEMBL4728789 | 0.69 | TACR1 (0.38) | TACR1 | |
| SCHEMBL4730933 | 0.67 | TACR1 (0.40) | TACR1CCR2ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL4731708 | 0.66 | TACR1 (0.45) | TACR1CCR2 | |
| SCHEMBL7919481 | 0.66 | ATM (0.53) | TACR1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL4731307 | 0.66 | CETP (0.44) | TACR1CCR2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008045564-A2 | CARBOXAMIDE COMPOUNDS AND THEIR USE AS ANTAGONISTS OF THE CHEMOKINE CCR2 RECEPTOR | EPIX DELAWARE, INC. (US) | 2008-04-17 | — | — | WO | claimed |