Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.41 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.40 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.40 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MITF | O75030 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.39 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | APAF1 | O14727 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9901077 | 0.81 | ALDH1A1 (0.47) | ALDH1A1NCOA1NCOA3TEAD4SMN1; SMN2 | |
| SCHEMBL9905767 | 0.77 | KDR (0.43) | ALDH1A1NCOA1NCOA3TEAD4SMN1; SMN2 | |
| SCHEMBL9905617 | 0.76 | PTGS2 (0.43) | ALDH1A1SMN1; SMN2MEN1KMT2APOLB | |
| SCHEMBL15293091 | 0.73 | DCPS (0.48) | ALDH1A1NCOA1NCOA3TEAD4KDM1A | |
| SCHEMBL9900459 | 0.73 | AR (0.43) | ALDH1A1SMN1; SMN2MEN1KMT2APOLB | |
| SCHEMBL31531346 | 0.73 | KDR (0.56) | ALDH1A1NCOA1NCOA3SMN1; SMN2MAPT | |
| SCHEMBL20854306 | 0.71 | TEAD4 (0.56) | ALDH1A1NCOA1NCOA3TEAD4SMN1; SMN2 | |
| SCHEMBL15284246 | 0.70 | DCPS (0.62) | DHFR | |
| SCHEMBL8404508 | 0.68 | ELANE (0.43) | TDP1MEN1KMT2AELANEMAPK1 | |
| SCHEMBL22830371 | 0.67 | ALDH1A1 (0.50) | ALDH1A1NCOA1NCOA3TEAD4SMN1; SMN2 |
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-2649066-A1 | HYDANTOIN DERIVATIVES USEFUL AS KV3 INHIBITORS | Autifony Therapeutics Limited (GB) | 2013-10-16 | — | — | EP | disclosed |
| WO-2012076877-A1 | HYDANTOIN DERIVATIVES USEFUL AS KV3 INHIBITORS | AUTIFONY THERAPEUTICS LIMITED (GB) | 2012-06-14 | — | — | WO | disclosed |