Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 8/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | THRA | P10827 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9365430 | 0.86 | GPR35 (0.45) | GPR35ALDH1A1KMT2ACYP1A2CYP2C19 | |
| SCHEMBL9368692 | 0.83 | GPR35 (0.53) | GPR35ALDH1A1KMT2AAKR1B1MEN1 | |
| SCHEMBL9364671 | 0.81 | GPR35 (0.60) | GPR35ALDH1A1KMT2AAKR1B1CYP1A2 | |
| SCHEMBL8904052 | 0.81 | PTPN5 (0.47) | GPR35ALDH1A1CYP1A2CYP2C19CYP3A4 | |
| SCHEMBL7976022 | 0.79 | GPR35 (0.57) | GPR35ALDH1A1KMT2ACYP1A2CYP2C19 | |
| SCHEMBL11400761 | 0.78 | GPR35 (1.00) | GPR35ALDH1A1KMT2ACYP1A2CYP2C19 | |
| SCHEMBL5973814 | 0.77 | GPR35 (0.55) | GPR35ALDH1A1KMT2AAKR1B1CYP1A2 | |
| SCHEMBL9364681 | 0.77 | GPR35 (0.55) | GPR35ALDH1A1KMT2AAKR1B1MAPT | |
| SCHEMBL9364628 | 0.74 | ALDH1A1 (0.50) | GPR35ALDH1A1KMT2AAKR1B1MAPT | |
| SCHEMBL9365550 | 0.74 | GPR35 (0.56) | GPR35ALDH1A1KMT2AAKR1B1MAPT |
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-0377112-B1 | Quinoxaline compounds and their preparation and use | NOVO NORDISK AS (DK) | 1994-08-24 | — | — | EP | disclosed |
| US-5061706-A | 2,3-QUINOXALINEDIONES FOR USE AS NEUROLEPTICS | NOVO NORDISK A/S (DK) | 1991-10-29 | — | — | US | disclosed |
| EP-0377112-A1 | Quinoxaline compounds and their preparation and use | NOVO NORDISK A/S (DK) | 1990-07-11 | — | — | EP | disclosed |