Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 4/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 3/20 | 0.38 |
| ▸ | DRD3 | P35462 | 3/20 | 0.38 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.37 |
| ▸ | RET | P07949 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | PRNP | P04156 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL2884811 | 0.92 | PARP1 (0.56) | PARP1ADORA2AADORA1BRD4DRD4 | |
| Methylethylamine SCHEMBL4724184 | 0.90 | PARP1 (0.45) | PARP1ADORA2AADORA1BRD4DRD4 | |
| Pyrrolidine SCHEMBL4766758 | 0.81 | PARP1 (0.46) | PARP1ADORA2AADORA1BRD4DRD4 | |
| Piperidine SCHEMBL4836157 | 0.80 | PARP1 (0.45) | PARP1ADORA2AADORA1BRD4DRD4 | |
| SCHEMBL21137030 | 0.76 | PARP1 (0.46) | PARP1BRD4DRD4DRD3DRD2 | |
| SCHEMBL1193116 | 0.72 | LMNA (0.42) | PARP1GPR84MEN1ALDH1A1PRNP | |
| SCHEMBL8667 | 0.72 | PARP1 (0.56) | PARP1BRD4DRD4DRD3DRD2 | |
| SCHEMBL29961305 | 0.72 | LMNA (0.42) | PARP1GPR84MEN1ALDH1A1PRNP | |
| SCHEMBL10842681 | 0.72 | PARP1 (0.60) | PARP1BRD4DRD4DRD3DRD2 | |
| Hydrochloric Acid SCHEMBL29243893 | 0.71 | LMNA (0.39) | PARP1BRD4MEN1ALDH1A1PRNP |
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-1994022-A2 | N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS | Wyeth a Corporation of the State of Delaware (US) | 2008-11-26 | — | — | EP | disclosed |
| WO-2007108936-A2 | N-SUBSTITUTED-AZACYCLYLAMINES AS HISTAMINE-3 ANTAGONISTS | WYETH (US) | 2007-09-27 | — | — | WO | disclosed |