Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.68 |
| ▸ | RAB9A | P51151 | 6/20 | 0.68 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | HPGD | P15428 | 5/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.55 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.54 |
| ▸ | RELA | Q04206 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | USP2 | O75604 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL11611972 | 0.85 | RAB9A (0.64) | NPC1RAB9AABCG2KDM4EALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL11613889 | 0.84 | RAB9A (0.62) | NPC1RAB9AABCG2KDM4EALDH1A1 | |
| SCHEMBL269580 | 0.82 | SMN1; SMN2 (0.70) | NPC1RAB9AKDM4EALDH1A1HPGD | |
| SCHEMBL29121418 | 0.82 | RAB9A (1.00) | NPC1RAB9AKDM4EALDH1A1HPGD | |
| SCHEMBL11341017 | 0.82 | EGFR (0.52) | NPC1RAB9AABCG2KDM4EALDH1A1 | |
| SCHEMBL32674532 | 0.82 | EGFR (0.52) | NPC1RAB9AABCG2KDM4EALDH1A1 | |
| SCHEMBL11615095 | 0.81 | ALDH1A1 (0.58) | NPC1RAB9AKDM4EALDH1A1HPGD | |
| SCHEMBL11614458 | 0.81 | RAB9A (0.65) | NPC1RAB9AKDM4EALDH1A1HPGD | |
| SCHEMBL12798151 | 0.81 | CSNK2A2 (0.73) | NPC1RAB9AABCG2KDM4EALDH1A1 | |
| SCHEMBL11822985 | 0.81 | RAB9A (0.67) | NPC1RAB9AKDM4EALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-3964896-A | Oxadiazole benzoic acid derivatives as herbicides | UNIROYAL, INC. (US) | 1976-06-22 | — | — | US | disclosed |