Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 9/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.41 |
| ▸ | DAO | P14920 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22860333 | 0.84 | ADRB1 (0.47) | HRH4NPC1RAB9ALOXL2PIN1 | |
| SCHEMBL2166020 | 0.83 | HRH4 (0.57) | HRH4MEN1KMT2AHRH3 | |
| SCHEMBL6644383 | 0.79 | APAF1 (0.48) | HRH4NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL6648114 | 0.76 | APAF1 (0.48) | HRH4NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL1483712 | 0.72 | TNKS (0.59) | HRH4NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL6883751 | 0.72 | NPC1 (0.76) | HRH4NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL15219331 | 0.72 | HRH4 (0.55) | HRH4NPC1RAB9ALOXL2TSHR | |
| SCHEMBL601515 | 0.72 | HRH4 (1.00) | HRH4NPC1RAB9AAKR1C3MEN1 | |
| SCHEMBL23010853 | 0.71 | HTR3A (0.54) | HRH4NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL6649111 | 0.67 | PDGFRB (0.47) | HRH4KDM4EALDH1A1TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021030620-A1 | HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS | NUVATION BIO INC. (US) | 2021-02-18 | — | — | WO | disclosed |