Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 5/20 | 0.54 |
| ▸ | DRD2 | P14416 | 8/20 | 0.51 |
| ▸ | DRD3 | P35462 | 7/20 | 0.51 |
| ▸ | HTR1A | P08908 | 2/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.48 |
| ▸ | HRH1 | P35367 | 1/20 | 0.48 |
| ▸ | HTR1D | P28221 | 1/20 | 0.47 |
| ▸ | GABRP | O00591 | 1/20 | 0.47 |
| ▸ | GABRD | O14764 | 1/20 | 0.47 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.47 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.47 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.47 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.47 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.47 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.47 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.47 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.47 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.47 |
| ▸ | GABRE | P78334 | 1/20 | 0.47 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8878843 | 0.94 | CCR2 (0.54) | CCR2DRD2DRD3KCNH2HRH1 | |
| SCHEMBL8877916 | 0.89 | KCNH2 (0.56) | CCR2DRD2HTR1AKCNH2GABRP | |
| SCHEMBL8878418 | 0.88 | CCR2 (0.56) | CCR2DRD2DRD3DRD4 | |
| SCHEMBL9035552 | 0.87 | KCNH2 (0.49) | CCR2DRD2DRD3KCNH2HTR1D | |
| SCHEMBL8878677 | 0.86 | CCR2 (0.54) | CCR2DRD2DRD3HTR1A | |
| SCHEMBL8879246 | 0.86 | CCR2 (0.54) | CCR2DRD2DRD3HTR1AKCNH2 | |
| SCHEMBL8877476 | 0.86 | CCR2 (0.53) | CCR2DRD2DRD3HTR1DDRD4 | |
| SCHEMBL8879189 | 0.85 | CCR2 (0.49) | CCR2DRD2DRD3DRD4 | |
| SCHEMBL8878336 | 0.84 | CCR2 (0.48) | CCR2DRD2DRD3HTR1DDRD4 | |
| SCHEMBL8876932 | 0.84 | ADRA1D (0.54) | CCR2DRD2KCNH2HTR1DDRD4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5670511-A | Indolepiperidine derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1997-09-23 | — | — | US | disclosed |
| EP-0722942-A1 | Indole piperidine derivatives | MERCK PATENT GmbH (DE) | 1996-07-24 | — | — | EP | disclosed |