Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.37 |
| ▸ | BACE1 | P56817 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.37 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | FNTA | P49354 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8083287 | 1.00 | ALDH1A1 (0.40) | ALDH1A1ALOX15MAPTCYP3A4TDP1 | |
| SCHEMBL8518205 | 0.99 | ALOX15 (0.39) | ALDH1A1ALOX15MAPTCYP3A4TDP1 | |
| SCHEMBL8086326 | 0.99 | ALOX15 (0.39) | ALDH1A1ALOX15MAPTCYP3A4TDP1 | |
| SCHEMBL8088140 | 0.98 | ALOX15 (0.38) | ALDH1A1ALOX15MAPTCYP3A4TDP1 | |
| SCHEMBL8088141 | 0.98 | ALOX15 (0.38) | ALDH1A1ALOX15MAPTCYP3A4TDP1 | |
| SCHEMBL8088134 | 0.93 | ALOX15 (0.43) | ALDH1A1ALOX15MAPTCYP3A4TDP1 | |
| SCHEMBL8088135 | 0.93 | ALOX15 (0.43) | ALDH1A1ALOX15MAPTCYP3A4TDP1 | |
| SCHEMBL8088136 | 0.91 | ALOX15 (0.42) | ALDH1A1ALOX15MAPTCYP3A4TDP1 | |
| SCHEMBL8088138 | 0.91 | ALOX15 (0.42) | ALDH1A1ALOX15MAPTCYP3A4TDP1 | |
| SCHEMBL14193111 | 0.90 | ALDH1A1 (0.41) | ALDH1A1ALOX15MAPTCYP3A4TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2000509034-A | — | — | 2000-07-18 | — | — | JP | claimed |
| EP-0902779-A2 | PHOSPHATE MIMICS | CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) | 1999-03-24 | — | — | EP | disclosed |
| WO-1997040006-A2 | PHOSPHATE MIMICS | CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) | 1997-10-30 | — | — | WO | disclosed |