Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HTR3A | P46098 | 1/20 | 0.37 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL3173074 | 0.85 | HTR3E (0.41) | KDM4EKMT2AHTR3ACHRM2CHRM1 | |
| SCHEMBL3175166 | 0.85 | HTR3E (0.41) | KDM4EKMT2AHTR3ACHRM2CHRM1 | |
| SCHEMBL3175135 | 0.80 | CYP2D6 (0.41) | CYP2D6HTR7KMT2AHTR3A | |
| SCHEMBL3173450 | 0.78 | TRPA1 (0.43) | KDM4ECYP2D6KMT2AHTR3AHPGD | |
| SCHEMBL3182429 | 0.71 | OPRM1 (0.48) | — | |
| SCHEMBL3991990 | 0.71 | ACHE (0.41) | KMT2ACHRM2CHRM1CHRM3 | |
| SCHEMBL3181741 | 0.71 | CYP2D6 (0.45) | KDM4ECYP2D6KMT2AHTR3AHPGD | |
| SCHEMBL5120140 | 0.70 | P2RX4 (0.49) | KDM4EKMT2ATSHRNPSR1 | |
| SCHEMBL3189813 | 0.69 | CHRNB4 (0.35) | KDM4EKMT2AHTR3ACHRM3 | |
| SCHEMBL3189831 | 0.69 | F10 (0.36) | HTR7HTR3ACHRM3 |
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-1833826-A2 | TRICYCLIC DELTA-OPIOID MODULATORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2007-09-19 | — | — | EP | disclosed |
| WO-2006069276-A2 | TRICYCLIC ō-OPIOID MODULATORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2006-06-29 | — | — | WO | disclosed |