Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.40 |
| ▸ | GYS1 | P13807 | 2/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 4/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | EDNRB | P24530 | 1/20 | 0.35 |
| ▸ | EDNRA | P25101 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | S1PR5 | Q9H228 | 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 | |
|---|---|---|---|---|
| SCHEMBL23886763 | 1.00 | NPC1 (0.42) | NPC1RAB9AMEN1KMT2AFFAR1 | |
| SCHEMBL23898550 | 0.92 | NPC1 (0.47) | NPC1RAB9AMEN1KMT2ASRD5A2 | |
| SCHEMBL30176364 | 0.88 | MEN1 (0.43) | NPC1RAB9AMEN1KMT2AFFAR1 | |
| SCHEMBL23886827 | 0.88 | MEN1 (0.43) | NPC1RAB9AMEN1KMT2AFFAR1 | |
| SCHEMBL23898552 | 0.84 | NPC1 (0.42) | NPC1RAB9AMEN1KMT2AFFAR1 | |
| SCHEMBL23898368 | 0.79 | KMT2A (0.41) | NPC1RAB9AMEN1KMT2ASRD5A2 | |
| SCHEMBL30176272 | 0.77 | NPC1 (0.50) | NPC1RAB9AMEN1KMT2ASRD5A2 | |
| SCHEMBL23886942 | 0.77 | NPC1 (0.50) | NPC1RAB9AMEN1KMT2ASRD5A2 | |
| SCHEMBL23898666 | 0.77 | MEN1 (0.39) | NPC1RAB9AMEN1KMT2AFFAR1 | |
| SCHEMBL23886885 | 0.75 | SCN9A (0.47) | NPC1RAB9AMEN1KMT2ASRD5A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115916749-A | Substituted 5-hydroxyindole compounds as alpha-1 antitrypsin modulators | 弗特克斯药品有限公司 | 2023-04-04 | — | — | CN | disclosed |
| EP-4126817-A1 | SUBSTITUTED 5-HYDROXYINDOLE COMPOUNDS AS MODULATORS OF ALPHA-1 ANTITRYPSIN | Vertex Pharmaceuticals Incorporated (US) | 2023-02-08 | — | — | EP | disclosed |