Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.76 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.76 |
| ▸ | MAPT | P10636 | 6/20 | 0.76 |
| ▸ | AR | P10275 | 5/20 | 0.76 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.76 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.76 |
| ▸ | HPGD | P15428 | 3/20 | 0.76 |
| ▸ | TP53 | P04637 | 2/20 | 0.76 |
| ▸ | MEN1 | O00255 | 3/20 | 0.74 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.74 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.74 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.74 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.74 |
| ▸ | TNKS | O95271 | 2/20 | 0.60 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | NPC1 | O15118 | 2/20 | 0.57 |
| ▸ | RAB9A | P51151 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL8934586 | 0.89 | ABCB1 (0.63) | ALDH1A1KDM4EMAPTARCYP3A4 | |
| SCHEMBL1629391 | 0.86 | ALDH1A1 (1.00) | ALDH1A1KDM4EMAPTARCYP3A4 | |
| SCHEMBL4649207 | 0.85 | KDM4E (1.00) | ALDH1A1KDM4EMAPTARCYP3A4 | |
| SCHEMBL31675935 | 0.85 | KDM4E (1.00) | ALDH1A1KDM4EMAPTARCYP3A4 | |
| SCHEMBL3825575 | 0.84 | AR (0.80) | ALDH1A1KDM4EMAPTARCYP3A4 | |
| SCHEMBL7603117 | 0.84 | AR (1.00) | ALDH1A1KDM4EMAPTARCYP3A4 | |
| SCHEMBL9137273 | 0.84 | AR (0.80) | ALDH1A1KDM4EMAPTARCYP3A4 | |
| SCHEMBL9141909 | 0.83 | AR (0.78) | ALDH1A1KDM4EMAPTARCYP3A4 | |
| SCHEMBL30848745 | 0.81 | AR (0.75) | ALDH1A1KDM4EMAPTARCYP3A4 | |
| SCHEMBL2481955 | 0.81 | AR (0.75) | ALDH1A1KDM4EMAPTARCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996031206-A2 | FLAVONES AND COUMARINS AS AGENTS FOR THE TREATMENT OF ATHEROSCLEROSIS | WARNER-LAMBERT COMPANY (US) | 1996-10-10 | — | — | WO | claimed |
| WO-1996031206-A2 | FLAVONES AND COUMARINS AS AGENTS FOR THE TREATMENT OF ATHEROSCLEROSIS | WARNER-LAMBERT COMPANY (US) | 1996-10-10 | — | — | WO | disclosed |