Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 5/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 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 | |
|---|---|---|---|---|
| SCHEMBL8904750 | 0.88 | NPSR1 (0.45) | ALDH1A1LMNARAB9ANPC1KDM4E | |
| SCHEMBL8905805 | 0.87 | LMNA (0.38) | ALDH1A1HTTLMNARAB9ANPC1 | |
| SCHEMBL8905900 | 0.86 | LMNA (0.37) | HTTLMNANPC1SMN1; SMN2AKR1B1 | |
| SCHEMBL8906156 | 0.86 | ALDH1A1 (0.35) | ALDH1A1HTTLMNARAB9ANPC1 | |
| SCHEMBL8904194 | 0.86 | CCNA2 (0.38) | ALDH1A1HTTLMNARAB9AAKR1B1 | |
| SCHEMBL8905938 | 0.86 | MEN1 (0.38) | ALDH1A1HTTLMNANPC1SMN1; SMN2 | |
| SCHEMBL9030270 | 0.85 | PDE3B (0.42) | ALDH1A1HTTLMNARAB9ANPC1 | |
| SCHEMBL8904850 | 0.85 | ALDH1A1 (0.40) | ALDH1A1HTTLMNASMN1; SMN2AKR1B1 | |
| SCHEMBL8904827 | 0.84 | PDE3B (0.36) | ALDH1A1HTTLMNARAB9ANPC1 | |
| SCHEMBL8904574 | 0.84 | NPC1 (0.42) | ALDH1A1HTTLMNARAB9ANPC1 |
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-5622948-A | ANALGESICS | SYNTEX (U.S.A.) INC. (US) | 1997-04-22 | — | — | US | disclosed |
| EP-0714895-A1 | Pyrrole derivatives | F. Hoffmann-La Roche AG (CH) | 1996-06-05 | — | — | EP | disclosed |