Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 5/20 | 0.43 |
| ▸ | RORC | P51449 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | UBE2M | P61081 | 5/20 | 0.37 |
| ▸ | DCUN1D1 | Q96GG9 | 5/20 | 0.37 |
| ▸ | CTSD | P07339 | 1/20 | 0.37 |
| ▸ | REN | P00797 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | MMP7 | P09237 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.36 |
| ▸ | CCR5 | P51681 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5027117 | 1.00 | CCR2 (0.43) | CCR2RORCCYP2D6KCNH2UBE2M | |
| SCHEMBL5027120 | 1.00 | CCR2 (0.43) | CCR2RORCCYP2D6KCNH2UBE2M | |
| SCHEMBL5031820 | 0.75 | CCR2 (0.39) | CCR2RORCCYP2D6KCNH2MEN1 | |
| SCHEMBL5031949 | 0.71 | SLC6A2 (0.38) | CCR2RORCCYP2D6KCNH2MEN1 | |
| SCHEMBL5033700 | 0.70 | CCR2 (0.44) | CCR2CYP2D6KCNH2RENCCR5 | |
| SCHEMBL5029381 | 0.70 | SLC6A4 (0.38) | CCR2RORCCYP2D6KCNH2 | |
| SCHEMBL5027340 | 0.69 | CCR2 (0.53) | CCR2CYP2D6KCNH2CCR5 | |
| SCHEMBL21359110 | 0.69 | CTSD (0.50) | DCUN1D1CTSDOPRM1MEN1KMT2A | |
| SCHEMBL3370759 | 0.68 | AGER (0.55) | DCUN1D1CTSDOPRM1MEN1KMT2A | |
| SCHEMBL21359174 | 0.68 | CTSD (0.49) | CTSDOPRM1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-7378409-B2 | Substituted cycloalkylamine derivatives as modulators of chemokine receptor activity | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-05-27 | — | — | US | disclosed |