Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPY5R | Q15761 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | TGM2 | P21980 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
| ▸ | MMP7 | P09237 | 1/20 | 0.34 |
| ▸ | MMP13 | P45452 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | F10 | P00742 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
| ▸ | MDM4 | O15151 | 1/20 | 0.31 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10805007 | 1.00 | NPY5R (0.36) | NPY5RMAPK1HSD11B1TGM2MMP1 | |
| SCHEMBL11151731 | 1.00 | NPY5R (0.36) | NPY5RMAPK1HSD11B1TGM2MMP1 | |
| Hydrochloric Acid SCHEMBL10806520 | 0.98 | NPY5R (0.36) | NPY5RMAPK1HSD11B1TGM2MMP1 | |
| Hydrochloric Acid SCHEMBL11152877 | 0.98 | NPY5R (0.36) | NPY5RMAPK1HSD11B1TGM2MMP1 | |
| Hydrochloric Acid SCHEMBL11144543 | 0.98 | NPY5R (0.36) | NPY5RMAPK1HSD11B1TGM2MMP1 | |
| SCHEMBL14244119 | 0.89 | — | — | |
| SCHEMBL9202125 | 0.81 | KDM4E (0.39) | NPY5RHSD11B1TGM2OPRM1PDE7A | |
| SCHEMBL17138583 | 0.81 | KDM4E (0.39) | NPY5RMAPK1HSD11B1TGM2MMP1 | |
| SCHEMBL13450563 | 0.80 | HSD11B1 (0.39) | NPY5RHSD11B1TGM2MMP1MMP2 | |
| SCHEMBL12385845 | 0.80 | HSD11B1 (0.39) | NPY5RHSD11B1TGM2MMP1MMP2 |
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-0096006-A2 | 3-(Ureidocyclohexylamino)-propane-1,2-diol derivatives, process for their preparation, pharmaceutical preparations containing these compounds and their therapeutical use | CIBA-GEIGY AG (CH) | 1983-12-07 | — | — | EP | claimed |
| US-4634713-A | ADRENERGIC BLOCKING AGENTS | CIBA-GEIGY CORPORATION (US) | 1987-01-06 | — | — | US | disclosed |
| EP-0096006-A2 | 3-(Ureidocyclohexylamino)-propane-1,2-diol derivatives, process for their preparation, pharmaceutical preparations containing these compounds and their therapeutical use | CIBA-GEIGY AG (CH) | 1983-12-07 | — | — | EP | disclosed |