Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.37 |
| ▸ | CBFB | Q13951 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | BRS3 | P32247 | 1/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | NCF1 | P14598 | 1/20 | 0.36 |
| ▸ | DGAT1 | O75907 | 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 | |
|---|---|---|---|---|
| SCHEMBL7809666 | 0.92 | ADRB2 (0.36) | TDP1PDE10ASLC22A12DYRK1AALDH1A1 | |
| SCHEMBL8565612 | 0.73 | MEN1 (0.48) | SLC22A12DYRK1AALDH1A1ADRB2NCF1 | |
| SCHEMBL4556153 | 0.72 | TDP1 (0.47) | TDP1PDE10AIDO1NPSR1MAOB | |
| SCHEMBL12635706 | 0.71 | TDP1 (0.55) | TDP1IDO1NPSR1ALDH1A1CYP1A2 | |
| SCHEMBL8565482 | 0.70 | ADRB2 (0.42) | SLC22A12DYRK1ADYRK1BALDH1A1ADRB2 | |
| SCHEMBL7808593 | 0.70 | TDP1 (0.54) | TDP1NPSR1DYRK1BCYP1A2 | |
| SCHEMBL7808663 | 0.69 | TDP1 (0.50) | TDP1NPSR1DYRK1BCBFBALDH1A1 | |
| Hydrochloric Acid SCHEMBL8480485 | 0.69 | TDP1 (0.52) | TDP1NPSR1DYRK1BCYP1A2 | |
| Hydrochloric Acid SCHEMBL8479187 | 0.69 | TDP1 (0.49) | TDP1NPSR1DYRK1BCBFBALDH1A1 | |
| SCHEMBL7808619 | 0.69 | TDP1 (0.52) | TDP1NPSR1CBFBCYP1A2CYP2C9 |
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-0820990-B1 | Benzimidazole, benzoxazole, and benzothiazole derivatives useful as interleukin 1beta inhibitors | ADIR (FR) | 2001-01-17 | — | — | EP | disclosed |
| US-5972968-A | INTERLEUKIN INHIBITOR | ADIR ET COMPAGNIE (FR) | 1999-10-26 | — | — | US | disclosed |
| EP-0820990-A2 | Novel benzimidazole, benzoxazole, and benzothiazole derivatives useful as interleukin 1beta inhibitors | ADIR ET COMPAGNIE (FR) | 1998-01-28 | — | — | EP | disclosed |