Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.38 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL663007 | 0.87 | TAAR1 (0.36) | TAAR1TBXAS1HTR1AALDH1A1KDM4E | |
| SCHEMBL9081974 | 0.86 | TAAR1 (0.35) | TAAR1TBXAS1HTR1AALDH1A1GLA | |
| SCHEMBL16448086 | 0.86 | TAAR1 (0.35) | TAAR1TBXAS1HTR1AALDH1A1GLA | |
| SCHEMBL9440949 | 0.77 | ALDH1A1 (0.37) | TAAR1TBXAS1HTR1AALDH1A1TSHR | |
| SCHEMBL6039823 | 0.76 | ALDH1A1 (0.33) | TAAR1TBXAS1HTR1AALDH1A1KDM4E | |
| SCHEMBL31169778 | 0.76 | ALDH1A1 (0.39) | TBXAS1ALDH1A1GLATSHRKDM4E | |
| SCHEMBL17493941 | 0.76 | MLYCD (0.42) | TAAR1TBXAS1HTR1ASMN1; SMN2NPC1 | |
| SCHEMBL4268278 | 0.74 | TAAR1 (0.47) | TAAR1HTR1AALDH1A1GLATSHR | |
| SCHEMBL2837058 | 0.73 | TAAR1 (0.42) | TAAR1TBXAS1HTR1AALDH1A1KDM4E | |
| SCHEMBL3684538 | 0.73 | ALDH1A1 (0.38) | TAAR1TBXAS1ALDH1A1KDM4ESMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1223933-A2 | 5-MEMBERED HETEROCYCLE DERIVATIVES, PRODUCTION THEREOF AND USE THEREOF AS MEDICAMENTS | SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) | 2002-07-24 | — | — | EP | claimed |
| WO-2001026656-A2 | 5-MEMBERED HETEROCYCLE DERIVATIVES AND USE THEREOF AS MONOAMINE OXIDASE INHIBITORS | SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) | 2001-04-19 | — | — | WO | claimed |