Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.57 |
| ▸ | RAB9A | P51151 | 4/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.41 |
| ▸ | EDNRB | P24530 | 2/20 | 0.40 |
| ▸ | EDNRA | P25101 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | MAOB | P27338 | 3/20 | 0.38 |
| ▸ | MAOA | P21397 | 2/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.38 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.38 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.38 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.37 |
| ▸ | CTSV | O60911 | 1/20 | 0.37 |
| ▸ | CTSL | P07711 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL23886650 | 1.00 | NPC1 (0.57) | NPC1RAB9AMEN1KMT2AS1PR3 | |
| SCHEMBL23898695 | 0.91 | MEN1 (0.47) | NPC1RAB9AMEN1KMT2AS1PR3 | |
| SCHEMBL23898585 | 0.86 | NPC1 (0.42) | NPC1RAB9AMEN1KMT2AS1PR3 | |
| SCHEMBL26654651 | 0.86 | MEN1 (0.38) | NPC1RAB9AMEN1KMT2AS1PR3 | |
| SCHEMBL28995423 | 0.85 | NPC1 (0.41) | NPC1RAB9AMEN1KMT2AS1PR3 | |
| SCHEMBL23886871 | 0.84 | MEN1 (0.41) | NPC1RAB9AMEN1KMT2AS1PR3 | |
| SCHEMBL30176361 | 0.84 | MEN1 (0.41) | NPC1RAB9AMEN1KMT2AS1PR3 | |
| SCHEMBL30176251 | 0.84 | S1PR3 (0.44) | NPC1RAB9AMEN1KMT2AS1PR3 | |
| SCHEMBL23886852 | 0.84 | S1PR3 (0.44) | NPC1RAB9AMEN1KMT2AS1PR3 | |
| SCHEMBL23886916 | 0.84 | S1PR3 (0.44) | NPC1RAB9AMEN1KMT2AS1PR3 |
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 |