Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.60 |
| ▸ | HPGD | P15428 | 3/20 | 0.60 |
| ▸ | NPC1 | O15118 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.54 |
| ▸ | ELANE | P08246 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.47 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.47 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.47 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.46 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2351713 | 0.92 | HSD11B1 (0.52) | RAB9AHPGDNPC1ALDH1A1MEN1 | |
| Hydrochloric Acid SCHEMBL27873129 | 0.90 | HSD11B1 (0.50) | RAB9AHPGDNPC1ALDH1A1ATM | |
| SCHEMBL11233382 | 0.83 | HPGD (0.64) | RAB9AHPGDNPC1ALDH1A1SRD5A2 | |
| SCHEMBL3305633 | 0.82 | HPGD (0.62) | RAB9AHPGDNPC1ALDH1A1SRD5A2 | |
| Benzophenone SCHEMBL27422465 | 0.80 | ALDH1A1 (0.78) | RAB9AHPGDNPC1ALDH1A1SRD5A2 | |
| SCHEMBL3455299 | 0.78 | KMT2A (0.66) | RAB9AHPGDNPC1ALDH1A1SRD5A2 | |
| Benzophenone SCHEMBL28482647 | 0.78 | ALDH1A1 (0.82) | RAB9AHPGDNPC1ALDH1A1SRD5A2 | |
| SCHEMBL9066312 | 0.78 | ALDH1A1 (0.93) | RAB9AHPGDNPC1ALDH1A1SRD5A2 | |
| Benzophenone SCHEMBL27498689 | 0.78 | ALDH1A1 (0.93) | RAB9AHPGDNPC1ALDH1A1SRD5A2 | |
| SCHEMBL314267 | 0.78 | ALDH1A1 (0.93) | RAB9AHPGDNPC1ALDH1A1SRD5A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1322599-A2 | HIV INTEGRASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2003-07-02 | — | — | EP | disclosed |
| WO-2001096283-A2 | HIV INTEGRASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2001-12-20 | — | — | WO | disclosed |