Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 3/20 | 0.45 |
| ▸ | GRIN2A | Q12879 | 3/20 | 0.45 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.34 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.34 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 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 | |
|---|---|---|---|---|
| SCHEMBL11847668 | 0.78 | CYP19A1 (0.54) | ALDH1A1CYP1A2CXCR3 | |
| SCHEMBL2308698 | 0.70 | GRIN1 (0.53) | GRIN1GRIN2AGRIN2BKMT2AMEN1 | |
| SCHEMBL2313192 | 0.70 | GRIN1 (0.55) | GRIN1GRIN2AGRIN2BALDH1A1AKR1C1 | |
| SCHEMBL14899045 | 0.68 | AKR1C1 (0.48) | ALDH1A1AKR1C1KMT2AMEN1APOBEC3A | |
| SCHEMBL7516255 | 0.68 | CYP19A1 (0.55) | — | |
| SCHEMBL18822335 | 0.66 | GRIN1 (0.48) | GRIN1GRIN2AGRIN2BAKR1C1KMT2A | |
| Hydrochloric Acid SCHEMBL6818616 | 0.66 | GRIN1 (0.51) | GRIN1GRIN2AGRIN2BKMT2AMEN1 | |
| SCHEMBL8115016 | 0.66 | OPRM1 (0.54) | GRIN1GRIN2AOPRM1 | |
| SCHEMBL11216766 | 0.65 | GRIN1 (0.50) | GRIN1GRIN2AGRIN2BALDH1A1AKR1C1 | |
| SCHEMBL11843650 | 0.65 | CYP19A1 (0.51) | KMT2AMEN1CXCR3OPRM1OPRL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5164386-A | Gastrointestinal and respiratory disorders | ISTITUTO DE ANGELI S.P.A. (IT) | 1992-11-17 | — | — | US | disclosed |
| EP-0404737-A2 | New R(-) 3-quinuclidinol derivatives | BOEHRINGER INGELHEIM ITALIA S.p.A. (IT) | 1990-12-27 | — | — | EP | disclosed |