Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.59 |
| ▸ | TERT | O14746 | 1/20 | 0.44 |
| ▸ | S100B | P04271 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.40 |
| ▸ | RECQL | P46063 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.39 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.39 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28173558 | 0.89 | ALDH1A1 (0.57) | ALDH1A1CYP3A4TERTS100BTSHR | |
| SCHEMBL1574035 | 0.84 | ALDH1A1 (0.71) | ALDH1A1CYP3A4TERTS100BTSHR | |
| SCHEMBL31554832 | 0.76 | ALDH1A1 (0.47) | ALDH1A1CYP3A4TERTS100BTSHR | |
| SCHEMBL30565134 | 0.76 | ALDH1A1 (0.61) | ALDH1A1CYP3A4TERTS100BTSHR | |
| SCHEMBL3425607 | 0.76 | ALDH1A1 (0.61) | ALDH1A1CYP3A4TERTS100BTSHR | |
| SCHEMBL30565135 | 0.76 | ALDH1A1 (0.61) | ALDH1A1CYP3A4TERTS100BTSHR | |
| SCHEMBL11638767 | 0.76 | ALDH1A1 (0.61) | ALDH1A1CYP3A4TERTS100BTSHR | |
| SCHEMBL8934320 | 0.76 | ALDH1A1 (0.61) | ALDH1A1CYP3A4TERTS100BTSHR | |
| SCHEMBL457496 | 0.76 | ALDH1A1 (0.61) | ALDH1A1CYP3A4TERTS100BTSHR | |
| SCHEMBL14283564 | 0.76 | ALDH1A1 (0.61) | ALDH1A1CYP3A4TERTS100BTSHR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0949695-B1 | Electroluminescent structure using blend systems | STARCK H C GMBH (DE) | 2009-06-17 | — | — | EP | disclosed |
| EP-0349034-B1 | Electrophotographic recording material | AGFA GEVAERT NV (BE) | 1994-01-12 | — | — | EP | disclosed |
| US-4923774-A | Layered electrophotographic recording element comprising p-type charge transport compounds | AGFA-GEVAERT, N.V. (BE) | 1990-05-08 | — | — | US | disclosed |
| EP-0349034-A1 | Electrophotographic recording material | AGFA-GEVAERT N.V. (BE) | 1990-01-03 | — | — | EP | disclosed |