Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | DAO | P14920 | 2/20 | 0.39 |
| ▸ | ACP3 | P15309 | 1/20 | 0.38 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 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 | |
|---|---|---|---|---|
| SCHEMBL8128225 | 0.81 | DAO (0.48) | HTTCYP2D6POLBDAO | |
| SCHEMBL4332381 | 0.77 | EPHX2 (0.48) | CYP2C19ALDH1A1SMN1; SMN2DAO | |
| SCHEMBL9456743 | 0.72 | CYP1A2 (1.00) | CYP1A2CYP2C19CYP2C9HPGDHTT | |
| SCHEMBL8663563 | 0.70 | ALDH1A1 (0.48) | CYP2C19HPGDHTTMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL8665315 | 0.68 | MAPT (0.37) | MEN1KMT2AALDH1A1 | |
| SCHEMBL8658341 | 0.68 | DAO (0.44) | CYP1A2CYP2C9HPGDHTTMEN1 | |
| SCHEMBL5638078 | 0.67 | CYP1A2 (1.00) | CYP1A2CYP2C19CYP2C9HPGDHTT | |
| SCHEMBL8661737 | 0.67 | EPHX2 (0.43) | HPGDHTTMEN1KMT2AALDH1A1 | |
| Hydrochloric Acid SCHEMBL6232539 | 0.66 | CYP1A2 (0.73) | CYP1A2CYP2C19CYP2C9HPGDHTT | |
| SCHEMBL13595850 | 0.66 | ACHE (0.49) | HPGDHTTMEN1KMT2AALDH1A1 |
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-5767140-A | USEFUL FOR TREATING AIDS | SOUTHERN RESEARCH INSTITUTE (US) | 1998-06-16 | — | — | US | disclosed |