Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | CASP1 | P29466 | 2/20 | 0.48 |
| ▸ | CASP7 | P55210 | 2/20 | 0.48 |
| ▸ | ATM | Q13315 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27812545 | 0.85 | HSD17B10 (0.45) | ALDH1A1HSD17B10HPGDTSHRKDM4E | |
| SCHEMBL15231639 | 0.85 | FDFT1 (0.54) | ALDH1A1HPGDGAANPC1RAB9A | |
| SCHEMBL18585961 | 0.83 | RBP4 (0.47) | ALDH1A1HPGDKDM4EGAASMN1; SMN2 | |
| SCHEMBL63894 | 0.83 | HDAC3 (0.54) | ALDH1A1HSD17B10HPGDTSHRKDM4E | |
| SCHEMBL13267179 | 0.82 | ALDH1A1 (0.55) | ALDH1A1HSD17B10HPGDTSHRKDM4E | |
| SCHEMBL15178478 | 0.82 | HSD17B10 (0.50) | ALDH1A1HSD17B10HPGDTSHRKDM4E | |
| SCHEMBL5516053 | 0.82 | KDM1A (0.40) | ALDH1A1MAPT | |
| SCHEMBL12631540 | 0.82 | CYP2C9 (0.56) | ALDH1A1MAPT | |
| SCHEMBL1198897 | 0.81 | NAMPT (0.60) | ALDH1A1KDM4EMAPTKMT2A | |
| SCHEMBL64063 | 0.81 | KDM4E (0.56) | ALDH1A1HSD17B10HPGDTSHRKDM4E |
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-2008059214-A1 | BISAMLDE DERIVATIVES AND USE THEREOF AS FATTY ACID SYNTHASE INHIBITORS | ASTRAZENECA AB (SE) | 2008-05-22 | — | — | WO | disclosed |