Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 2/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.37 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7337825 | 0.80 | ALDH1A1 (0.58) | IDO1NPC1ALDH1A1RAB9AGAA | |
| SCHEMBL7338245 | 0.78 | DCTPP1 (0.49) | DCTPP1IDO1ALDH1A1GAAKDM4E | |
| SCHEMBL7338080 | 0.73 | DCTPP1 (0.42) | DCTPP1NPC1ALDH1A1RAB9AGAA | |
| SCHEMBL7332530 | 0.73 | DCTPP1 (0.41) | DCTPP1IDO1ALDH1A1RAB9AKDM4E | |
| SCHEMBL7897464 | 0.72 | MAPT (0.44) | DCTPP1NPC1ALDH1A1RAB9AKDM4E | |
| SCHEMBL10969876 | 0.65 | ALDH1A1 (0.47) | NPC1ALDH1A1RAB9AGAAKDM4E | |
| SCHEMBL28713425 | 0.64 | NPC1 (0.61) | NPC1ALDH1A1RAB9AGAASMN1; SMN2 | |
| SCHEMBL27474789 | 0.64 | ALDH1A1 (0.46) | NPC1ALDH1A1RAB9AGAASMN1; SMN2 | |
| SCHEMBL7337818 | 0.64 | ALDH1A1 (0.38) | IDO1NPC1ALDH1A1RAB9AGAA | |
| SCHEMBL9123008 | 0.63 | CYP11B1 (0.53) | IDO1ALDH1A1GAAKEAP1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-6191124-B1 | VIRICIDES | PHARMACIA & UPJOHN COMPANY | 2001-02-20 | — | — | US | disclosed |
| EP-0757692-A1 | METHANOL DERIVATIVES FOR TREATMENT OF RETROVIRAL INFECTIONS ESPECIALLY HIV INFECTIONS | PHARMACIA & UPJOHN COMPANY (US) | 1997-02-12 | — | — | EP | disclosed |
| WO-1995029922-A1 | METHANOL DERIVATIVES FOR TREATMENT OF RETROVIRAL INFECTIONS ESPECIALLY HIV INFECTIONS | PHARMACIA & UPJOHN COMPANY (US) | 1995-11-09 | — | — | WO | disclosed |