Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.61 |
| ▸ | RAB9A | P51151 | 3/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.61 |
| ▸ | RHEB | Q15382 | 4/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | GUSB | P08236 | 2/20 | 0.46 |
| ▸ | AMY1A | P0DUB6 | 2/20 | 0.45 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.45 |
| ▸ | CBFB | Q13951 | 1/20 | 0.45 |
| ▸ | KDR | P35968 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | PLG | P00747 | 3/20 | 0.43 |
| ▸ | PLAU | P00749 | 3/20 | 0.43 |
| ▸ | F10 | P00742 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27762363 | 0.85 | NPC1 (0.55) | NPC1RAB9AMEN1KMT2ARHEB | |
| SCHEMBL2951537 | 0.84 | NPC1 (0.49) | NPC1RAB9AMEN1KMT2ARHEB | |
| SCHEMBL29824605 | 0.84 | NPC1 (0.49) | NPC1RAB9AMEN1KMT2ARHEB | |
| SCHEMBL2951540 | 0.84 | ALDH1A1 (0.61) | NPC1RAB9AMEN1KMT2AKDM4E | |
| SCHEMBL7511409 | 0.82 | NPC1 (0.55) | NPC1RAB9AMEN1KMT2ARHEB | |
| SCHEMBL7515773 | 0.80 | NPC1 (0.56) | NPC1RAB9AMEN1KMT2ARHEB | |
| SCHEMBL15876215 | 0.80 | NPC1 (0.62) | NPC1RAB9AMEN1KMT2ARHEB | |
| SCHEMBL784353 | 0.79 | NPC1 (0.66) | NPC1RAB9AMEN1KMT2AKDM4E | |
| SCHEMBL31677102 | 0.79 | NPC1 (0.66) | NPC1RAB9AMEN1KMT2AKDM4E | |
| SCHEMBL29825055 | 0.79 | NPC1 (0.66) | NPC1RAB9AMEN1KMT2AKDM4E |
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-2021022061-A1 | ARYL HYDROCARBON RECEPTOR ACTIVATORS | OREGON STATE UNIVERSITY (US) | 2021-02-04 | — | — | WO | disclosed |