Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 2/20 | 0.41 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.41 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.41 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.41 |
| ▸ | TKT | P29401 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | NOS3 | P29474 | 1/20 | 0.40 |
| ▸ | NOS1 | P29475 | 1/20 | 0.40 |
| ▸ | NOS2 | P35228 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL27528591 | 0.84 | ALDH1A1 (0.47) | ALDH1A1KDM4ENAPRTCASP3SENP8 | |
| SCHEMBL24107506 | 0.80 | ALDH1A1 (0.44) | ALDH1A1KDM4ECASP3SENP8SENP7 | |
| SCHEMBL21155351 | 0.78 | ALDH1A1 (0.42) | ALDH1A1CASP3SENP8SENP7SENP6 | |
| SCHEMBL9535223 | 0.78 | L3MBTL1 (0.51) | ALDH1A1NPC1HTTTSHRL3MBTL1 | |
| SCHEMBL27486669 | 0.78 | MEN1 (0.51) | ALDH1A1KDM4ECASP3SENP8SENP7 | |
| SCHEMBL9828121 | 0.78 | MEN1 (0.47) | ALDH1A1KDM4EHTTTSHRL3MBTL1 | |
| SCHEMBL8357655 | 0.77 | NPC1 (0.47) | ALDH1A1KDM4ENAPRTTKTNPC1 | |
| SCHEMBL14313760 | 0.76 | ALDH1A1 (0.46) | ALDH1A1KDM4ECASP3SENP8SENP7 | |
| SCHEMBL5255523 | 0.76 | ALDH1A1 (0.65) | ALDH1A1KDM4EL3MBTL1RAB9ACYP1A2 | |
| SCHEMBL11722079 | 0.75 | LTA4H (0.43) | ALDH1A1KDM4ENAPRTTKTNPC1 |
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-4687775-A | ANTIULCER AGENTS | G. D. SEARLE & CO. (US) | 1987-08-18 | — | — | US | disclosed |