Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.46 |
| ▸ | RAB9A | P51151 | 5/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.46 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.46 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.46 |
| ▸ | ABL1 | P00519 | 3/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.43 |
| ▸ | BCR | P11274 | 3/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | ERN1 | O75460 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MITF | O75030 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL10601743 | 0.94 | NPC1 (0.48) | NPC1RAB9ASMN1; SMN2TP53MAPK1 | |
| SCHEMBL11045690 | 0.94 | NPC1 (0.48) | NPC1RAB9ASMN1; SMN2TP53MAPK1 | |
| SCHEMBL10600119 | 0.94 | NPC1 (0.48) | NPC1RAB9ASMN1; SMN2TP53MAPK1 | |
| SCHEMBL11047143 | 0.92 | TDP1 (0.47) | NPC1RAB9ASMN1; SMN2TP53MAPK1 | |
| SCHEMBL10602675 | 0.90 | MAOB (0.40) | NPC1RAB9ASMN1; SMN2TP53MAPK1 | |
| SCHEMBL6688965 | 0.89 | NPC1 (0.55) | NPC1RAB9ASMN1; SMN2TP53MAPK1 | |
| SCHEMBL11044007 | 0.88 | ACHE (0.41) | NPC1RAB9ASMN1; SMN2TP53MAPK1 | |
| SCHEMBL10389211 | 0.87 | CYP2D6 (0.43) | SMN1; SMN2ERN1HTT | |
| SCHEMBL11050461 | 0.86 | ABL1 (0.50) | NPC1RAB9ASMN1; SMN2TP53MAPK1 | |
| Perchlorate SCHEMBL11044837 | 0.86 | NPC1 (0.51) | NPC1RAB9ASMN1; SMN2TP53MAPK1 |
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-4474868-A | ORGANIC PEROXIDE AND COMPOUND CONTAINING CATIONIC OXYGEN, SULFUR OXYGEN,SULFUR OR SELENIUM | NIPPON OIL AND FATS CO., LTD. (JP) | 1984-10-02 | — | — | US | disclosed |