Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 4/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.45 |
| ▸ | PTAFR | P25105 | 2/20 | 0.40 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.35 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.35 |
| ▸ | TUBB | P07437 | 1/20 | 0.35 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.35 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.35 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL17375719 | 0.70 | ACHE (0.51) | ACHEPTPN1PTAFRMAPK3MAPK1 | |
| SCHEMBL17371470 | 0.70 | ACHE (0.51) | ACHEPTPN1PTAFRMAPK3MAPK1 | |
| SCHEMBL178390 | 0.69 | ACHE (0.50) | ACHECYP3A4MEN1KMT2AMAPT | |
| SCHEMBL726736 | 0.68 | TDP1 (0.41) | CYP3A4ALDH1A1 | |
| SCHEMBL3266043 | 0.67 | ALDH1A1 (0.51) | ACHEPTPN1PTAFRMAPK3MAPK1 | |
| SCHEMBL3266050 | 0.67 | ALDH1A1 (0.51) | ACHEPTPN1PTAFRMAPK3MAPK1 | |
| SCHEMBL6822928 | 0.66 | PTAFR (0.69) | ACHEPTPN1PTAFRMAPK3MAPK1 | |
| SCHEMBL5752901 | 0.66 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL686849 | 0.65 | CYP1A2 (0.64) | ACHECYP3A4ALDH1A1MAPTCA9 | |
| SCHEMBL11101046 | 0.65 | ACHE (0.58) | ACHEPTPN1PTAFRMAPK3MAPK1 |
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-4335126-A | SEDATIVES, TRANQUILIZERS, AND ANTIPYRETICS; NEUROLEPTIC AND ANTIEDEMIC AGENTS | DEGUSSA AKTIENGESELLSCHAFT (DE) | 1982-06-15 | — | — | US | disclosed |