Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.72 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.72 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.72 |
| ▸ | NPC1 | O15118 | 3/20 | 0.72 |
| ▸ | RAB9A | P51151 | 3/20 | 0.72 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.72 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.72 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.53 |
| ▸ | IDO1 | P14902 | 1/20 | 0.51 |
| ▸ | RHEB | Q15382 | 1/20 | 0.50 |
| ▸ | KDR | P35968 | 5/20 | 0.48 |
| ▸ | GUSB | P08236 | 1/20 | 0.47 |
| ▸ | METAP2 | P50579 | 1/20 | 0.46 |
| ▸ | METAP1 | P53582 | 1/20 | 0.46 |
| ▸ | CBFB | Q13951 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3078070 | 0.84 | NPC1 (1.00) | HPGDKDM4EALDH1A1NPC1RAB9A | |
| SCHEMBL29858384 | 0.84 | NPC1 (1.00) | HPGDKDM4EALDH1A1NPC1RAB9A | |
| SCHEMBL2951537 | 0.82 | NPC1 (0.49) | HPGDKDM4EALDH1A1NPC1RAB9A | |
| SCHEMBL29824605 | 0.82 | NPC1 (0.49) | HPGDKDM4EALDH1A1NPC1RAB9A | |
| SCHEMBL22956060 | 0.82 | GUSB (0.53) | HPGDKDM4EALDH1A1NPC1RAB9A | |
| SCHEMBL22955333 | 0.79 | AMY1A (0.57) | NPC1RAB9AGUSBAMY1A | |
| SCHEMBL21643218 | 0.77 | GUSB (0.55) | HPGDKDM4EALDH1A1NPC1RAB9A | |
| SCHEMBL13405888 | 0.77 | ALDH1A1 (0.71) | HPGDKDM4EALDH1A1NPC1RAB9A | |
| SCHEMBL22955644 | 0.76 | GUSB (0.45) | HPGDKDM4EALDH1A1NPC1RAB9A | |
| SCHEMBL10579296 | 0.76 | KDM4E (0.60) | HPGDKDM4EALDH1A1NPC1RAB9A |
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 |