Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 2/20 | 0.49 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.49 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.45 |
| ▸ | GRM5 | P41594 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.43 |
| ▸ | PDE5A | O76074 | 1/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.43 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL286897 | 0.88 | PTPN1 (0.50) | HCRTR1HCRTR2PTPN1GRM5TRPV1 | |
| SCHEMBL2276390 | 0.87 | PTPN1 (0.49) | HCRTR1HCRTR2PTPN1GRM5TRPV1 | |
| SCHEMBL353286 | 0.87 | MAPT (0.48) | HCRTR1HCRTR2PTPN1GRM5TRPV1 | |
| SCHEMBL5655399 | 0.87 | HCRTR1 (0.43) | HCRTR1HCRTR2PTPN1TRPV1PDE4D | |
| Zinc Ion SCHEMBL9440268 | 0.85 | HCRTR1 (0.46) | HCRTR1HCRTR2PTPN1GRM5TRPV1 | |
| SCHEMBL2450038 | 0.85 | L3MBTL1 (0.53) | HCRTR1HCRTR2PTPN1GRM5TRPV1 | |
| SCHEMBL4066351 | 0.85 | ALDH1A1 (0.49) | HCRTR1HCRTR2PTPN1GRM5TRPV1 | |
| SCHEMBL7267932 | 0.84 | BRD4 (0.56) | HCRTR1HCRTR2PTPN1GRM5PDE4A | |
| SCHEMBL9232506 | 0.84 | PTPN1 (0.47) | HCRTR1HCRTR2PTPN1GRM5TRPV1 | |
| SCHEMBL19537492 | 0.84 | PTPN1 (0.50) | HCRTR1HCRTR2PTPN1GRM5TRPV1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102781942-A | Disubstituted octahy-dropyrrolo [3,4-c]pyrroles as orexin receptor modulators | JANSSEN PHARMACEUTICA NV | 2012-11-14 | — | — | CN | claimed |
| CN-102781942-A | Disubstituted octahy-dropyrrolo [3,4-c]pyrroles as orexin receptor modulators | JANSSEN PHARMACEUTICA NV | 2012-11-14 | — | — | CN | disclosed |