Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.57 |
| ▸ | HPGD | P15428 | 8/20 | 0.57 |
| ▸ | TSHR | P16473 | 3/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.57 |
| ▸ | MAPT | P10636 | 4/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.57 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.57 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | GSK3B | P49841 | 1/20 | 0.48 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9401135 | 0.91 | ALDH1A1 (0.57) | ALDH1A1KDM4EHSD17B10HPGDTSHR | |
| SCHEMBL9401139 | 0.88 | ALDH1A1 (0.54) | ALDH1A1KDM4EHSD17B10HPGDTSHR | |
| SCHEMBL9401166 | 0.84 | MTNR1A (0.58) | ALDH1A1KDM4EHSD17B10HPGDMAPT | |
| SCHEMBL9401143 | 0.83 | KDM4E (0.53) | ALDH1A1KDM4EHSD17B10HPGDTSHR | |
| SCHEMBL5184374 | 0.80 | ALDH1A1 (0.65) | ALDH1A1KDM4EHSD17B10HPGDTSHR | |
| SCHEMBL28687425 | 0.79 | ALDH1A1 (0.67) | ALDH1A1KDM4EHSD17B10HPGDTSHR | |
| SCHEMBL5728171 | 0.74 | KDM4E (0.64) | ALDH1A1KDM4EHSD17B10HPGDTSHR | |
| SCHEMBL6768454 | 0.73 | MTNR1A (0.59) | ALDH1A1KDM4EHPGDTSHRCYP3A4 | |
| SCHEMBL1626901 | 0.72 | MTNR1A (1.00) | ALDH1A1HPGDTSHRCYP3A4CYP2C19 | |
| SCHEMBL5510275 | 0.71 | KDM4E (0.56) | ALDH1A1KDM4EHPGDTSHRCYP3A4 |
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-5314908-A | Compounds useful as antiproliferative agents | WHITBY RESEARCH, INC. (US) | 1994-05-24 | — | — | US | disclosed |