Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 4/20 | 0.46 |
| ▸ | CCR5 | P51681 | 2/20 | 0.46 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.36 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.36 |
| ▸ | BTK | Q06187 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | TRPC3 | Q13507 | 1/20 | 0.35 |
| ▸ | TRPC6 | Q9Y210 | 1/20 | 0.35 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18924971 | 0.92 | CCR2 (0.47) | CCR2CCR5BTKHPGDPAK1 | |
| SCHEMBL24176496 | 0.92 | CCR2 (0.47) | CCR2CCR5BTKHPGDPAK1 | |
| SCHEMBL3110116 | 0.90 | CCR2 (0.44) | CCR2CCR5BTKHPGDPAK1 | |
| SCHEMBL15966231 | 0.90 | CCR2 (0.44) | CCR2CCR5BTKHPGDPAK1 | |
| SCHEMBL18215076 | 0.87 | CCR2 (0.46) | CCR2CCR5BTKALDH1A1PAK1 | |
| SCHEMBL15033716 | 0.87 | CCR2 (0.46) | CCR2CCR5BTKALDH1A1HPGD | |
| SCHEMBL24176138 | 0.85 | CCR2 (0.46) | CCR2CCR5BTKALDH1A1HPGD | |
| SCHEMBL24176498 | 0.85 | CCR2 (0.46) | CCR2CCR5BTKALDH1A1HPGD | |
| SCHEMBL3053389 | 0.85 | CCR2 (0.41) | CCR2CCR5HPGDKDM4ESMN1; SMN2 | |
| SCHEMBL3052720 | 0.85 | CCR2 (0.41) | CCR2CCR5HPGDKDM4ESMN1; SMN2 |
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-3091012-B1 | CCR2 RECEPTOR ANTAGONISTS AND USES THEREOF | CENTREXION THERAPEUTICS CORP (US) | 2018-04-11 | — | — | EP | disclosed |