Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.41 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2645837 | 0.80 | ALDH1A1 (0.44) | ALDH1A1MAPTHPGDNPSR1L3MBTL1 | |
| SCHEMBL31546405 | 0.79 | NOTUM (0.47) | ALDH1A1NPC1RAB9AKDM4EGAA | |
| SCHEMBL2645840 | 0.79 | KDM4E (0.47) | ALDH1A1NPC1RAB9AMAPTKDM4E | |
| SCHEMBL21034046 | 0.79 | LTB4R2 (0.51) | ALDH1A1FTOLTB4R2 | |
| SCHEMBL15479756 | 0.79 | DHODH (0.48) | ALDH1A1NPC1RAB9AGAASMN1; SMN2 | |
| SCHEMBL31546406 | 0.79 | FTO (0.49) | ALDH1A1NPC1RAB9AKDM4EGAA | |
| SCHEMBL10104417 | 0.79 | NOTUM (0.47) | ALDH1A1NPC1RAB9AKDM4EGAA | |
| SCHEMBL21634961 | 0.79 | ALDH1A1 (0.42) | ALDH1A1NPC1RAB9AMAPTKDM4E | |
| SCHEMBL6710242 | 0.77 | IDO1 (0.49) | ALDH1A1RAB9AMAPTKDM4EGLA | |
| SCHEMBL2889340 | 0.77 | GRIK1 (0.47) | ALDH1A1SMN1; SMN2NPSR1FTOTBK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005056532-A1 | INDAZOLE DERIVATIVES WHICH INTERACT WITH THE G-PROTEIN COUPLED RECEPTOR FAMILY | BIOFOCUS DISCOVERY LIMITED (GB) | 2005-06-23 | — | — | WO | disclosed |
| US-5438063-A | Hypotensive agents, cardiac insufficiency, increased intraocular pressure, and CNS disorders | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1995-08-01 | — | — | US | disclosed |
| EP-0628556-A1 | Imidazopyridines | MERCK PATENT GmbH (DE) | 1994-12-14 | — | — | EP | disclosed |