Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.44 |
| ▸ | VNN1 | O95497 | 2/20 | 0.44 |
| ▸ | P4HB | P07237 | 2/20 | 0.43 |
| ▸ | GRM5 | P41594 | 4/20 | 0.43 |
| ▸ | FBP1 | P09467 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.43 |
| ▸ | BRAF | P15056 | 1/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.42 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL8646712 | 1.00 | ALDH1A1 (0.49) | ALDH1A1MAPTAKR1C1VNN1P4HB | |
| SCHEMBL7449069 | 1.00 | ALDH1A1 (0.49) | ALDH1A1MAPTAKR1C1VNN1P4HB | |
| SCHEMBL8648599 | 0.82 | ALDH1A1 (0.42) | ALDH1A1MAPTVNN1P4HBGRM5 | |
| SCHEMBL8646375 | 0.81 | AKR1C1 (0.68) | ALDH1A1MAPTAKR1C1MEN1KMT2A | |
| SCHEMBL8646379 | 0.81 | AKR1C1 (0.68) | ALDH1A1MAPTAKR1C1MEN1KMT2A | |
| SCHEMBL8649420 | 0.81 | AKR1C3 (0.56) | ALDH1A1MAPTAKR1C1MEN1KMT2A | |
| SCHEMBL8649414 | 0.81 | AKR1C3 (0.56) | ALDH1A1MAPTAKR1C1MEN1KMT2A | |
| SCHEMBL622907 | 0.80 | AKR1C1 (0.62) | ALDH1A1AKR1C1P4HBFBP1MEN1 | |
| SCHEMBL622906 | 0.80 | AKR1C1 (0.62) | ALDH1A1AKR1C1P4HBFBP1MEN1 | |
| SCHEMBL8645516 | 0.78 | TSHR (0.54) | ALDH1A1AKR1C1VNN1P4HBMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1189879-A1 | INHIBITORS OF FACTOR Xa | COR THERAPEUTICS, INC. (US) | 2002-03-27 | — | — | EP | disclosed |
| WO-2000071512-A1 | INHIBITORS OF FACTOR Xa | COR THERAPEUTICS, INC. (US) | 2000-11-30 | — | — | WO | disclosed |
| EP-0861831-A1 | HETEROARYL-SUBSTITUTED ACRYLOYLGUANIDINE DERIVATIVES AND MEDICINAL COMPOSITION THEREOF | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1998-09-02 | — | — | EP | disclosed |