Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.43 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | MMP12 | P39900 | 1/20 | 0.41 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8476579 | 0.92 | MEN1 (0.43) | NPC1RAB9AMEN1KMT2AHTT | |
| SCHEMBL8479732 | 0.90 | MEN1 (0.52) | NPC1RAB9AMEN1KMT2AHTT | |
| SCHEMBL8109540 | 0.90 | MEN1 (0.52) | NPC1RAB9AMEN1KMT2AHTT | |
| SCHEMBL8481421 | 0.90 | MEN1 (0.52) | NPC1RAB9AMEN1KMT2AHTT | |
| SCHEMBL8477371 | 0.90 | CYP19A1 (0.50) | MEN1KMT2AALDH1A1ADRB1ADRB3 | |
| SCHEMBL8118464 | 0.90 | CLK4 (0.44) | MEN1KMT2AALDH1A1CACNA1G | |
| SCHEMBL8117055 | 0.88 | GRIN1 (0.43) | NPC1RAB9AMEN1KMT2AALDH1A1 | |
| SCHEMBL8476408 | 0.88 | MARS1 (0.47) | NPC1RAB9AMEN1KMT2AALDH1A1 | |
| SCHEMBL7829883 | 0.88 | MEN1 (0.45) | MEN1KMT2AALDH1A1ADRB1ADRB3 | |
| SCHEMBL7829887 | 0.88 | MEN1 (0.45) | MEN1KMT2AALDH1A1ADRB1ADRB3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5977105-A | Compounds | ASTRA PHARMAEUTICALS LTD. (GB) | 1999-11-02 | — | — | US | disclosed |
| EP-0865431-A2 | COMPOUNDS | Astra Pharmaceuticals Limited (GB) | 1998-09-23 | — | — | EP | disclosed |
| WO-1997020815-A1 | COMPOUNDS | ASTRA PHARMACEUTICALS LTD. (GB) | 1997-06-12 | — | — | WO | disclosed |