Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.34 |
| ▸ | CSF1R | P07333 | 1/20 | 0.34 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.34 |
| ▸ | CDC7 | O00311 | 1/20 | 0.34 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19862537 | 0.98 | NPC1 (0.40) | NPC1RAB9AKDM4EALDH1A1HPGD | |
| SCHEMBL25690928 | 0.94 | NPC1 (0.37) | NPC1RAB9AKDM4EALDH1A1HPGD | |
| SCHEMBL14488002 | 0.90 | — | — | |
| SCHEMBL8489672 | 0.82 | HPGDS (0.48) | HPGDS | |
| SCHEMBL17619231 | 0.81 | MAPK1 (0.39) | CSF1RHPGDS | |
| Hydrochloric Acid SCHEMBL22468947 | 0.81 | HPGDS (0.47) | HPGDS | |
| SCHEMBL22860618 | 0.79 | PARP1 (0.44) | HPGDS | |
| SCHEMBL10061828 | 0.78 | CDC7 (0.41) | NPC1RAB9AKDM4EALDH1A1ADORA2A | |
| SCHEMBL6633132 | 0.76 | KDM4E (0.37) | NPC1RAB9AKDM4EALDH1A1HPGD | |
| SCHEMBL25690929 | 0.74 | PDE1B (0.34) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023088493-A1 | FURO-PYRIDONE COMPOUND AND USE THEREOF | 中国科学院广州生物医药与健康研究院 | 2023-05-25 | — | — | WO | disclosed |
| CN-1222525-C | Bicyclic imidazol-3-ylamine derivatives substituted on a six-membered ring | GRUENENTHAL GMBH (DE) | 2005-10-12 | — | — | CN | disclosed |
| EP-1483265-A1 | PURINE DERIVATIVES AS KINASE INHIBITORS | ELI LILLY AND COMPANY (US) | 2004-12-08 | — | — | EP | disclosed |
| WO-2003076442-A1 | PURINE DERIVATIVES AS KINASE INHIBITORS | ELI LILLY AND COMPANY (US) | 2003-09-18 | — | — | WO | disclosed |
| CN-1402727-A | Bicyclic imidazo-3-yl-amine derivs. which are substd. on sixth ring | GRUENENTHAL GMBH (DE) | 2003-03-12 | — | — | CN | disclosed |