Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.60 |
| ▸ | LMNA | P02545 | 4/20 | 0.57 |
| ▸ | MCOLN3 | Q8TDD5 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | TSHR | P16473 | 4/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8588242 | 0.98 | GPBAR1 (0.56) | GPBAR1LMNAMCOLN3ALDH1A1TSHR | |
| SCHEMBL8543576 | 0.96 | MCOLN3 (0.58) | GPBAR1LMNAMCOLN3ALDH1A1TSHR | |
| SCHEMBL8541489 | 0.90 | KDM4E (0.60) | LMNAALDH1A1TSHRUSP2HSD17B10 | |
| SCHEMBL8539014 | 0.90 | L3MBTL1 (0.51) | GPBAR1LMNAMCOLN3ALDH1A1TSHR | |
| SCHEMBL8544818 | 0.85 | AKR1C3 (0.44) | GPBAR1LMNAMCOLN3ALDH1A1TSHR | |
| SCHEMBL9054130 | 0.80 | KMT2A (0.63) | LMNAMCOLN3ALDH1A1TSHRMEN1 | |
| SCHEMBL9058745 | 0.79 | PDE4A (0.69) | LMNAALDH1A1TSHRSMN1; SMN2MEN1 | |
| SCHEMBL9054500 | 0.79 | DRD2 (0.53) | — | |
| SCHEMBL8544972 | 0.78 | DRD2 (0.56) | — | |
| SCHEMBL9059468 | 0.78 | SMN1; SMN2 (0.53) | LMNAALDH1A1SMN1; SMN2NPSR1HSD17B10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0705259-B1 | PHENYRROLE DERIVATIVES AND THEIR USE AS DOPAMINE D3 ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1998-02-25 | — | — | EP | disclosed |
| EP-0705259-A1 | PHENYRROLE DERIVATIVES AND THEIR USE AS DOPAMINE D3 ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1996-04-10 | — | — | EP | disclosed |
| WO-1995000508-A1 | PHENYRROLE DERIVATIVES AND THEIR USE AS DOPAMINE D3 ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1995-01-05 | — | — | WO | disclosed |