Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCN4 | Q9Y3Q4 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.33 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.33 |
| ▸ | CCR5 | P51681 | 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 | |
|---|---|---|---|---|
| SCHEMBL9213910 | 0.95 | HCN4 (0.40) | HCN4MAPTCYP3A4ALOX15CHRM2 | |
| SCHEMBL9205217 | 0.92 | HCN4 (0.40) | HCN4MAPTCYP3A4ALOX15CHRM2 | |
| SCHEMBL9207476 | 0.92 | HTR1A (0.33) | HTR1AMEN1KMT2AMAOAMAOB | |
| SCHEMBL9208988 | 0.90 | HCN4 (0.41) | HCN4MAPTCYP3A4ALOX15CHRM2 | |
| Hydrochloric Acid SCHEMBL9740138 | 0.89 | CYP3A4 (0.41) | HCN4MAPTCYP3A4ALOX15CHRM2 | |
| SCHEMBL9215882 | 0.89 | LTA4H (0.32) | HTR1AMEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL9207815 | 0.88 | HCN4 (0.40) | HCN4MAPTCYP3A4ALOX15CHRM2 | |
| SCHEMBL9210183 | 0.87 | HCN4 (0.40) | HCN4MAPTCYP3A4ALOX15CHRM2 | |
| Hydrochloric Acid SCHEMBL9742883 | 0.87 | CYP3A4 (0.38) | HCN4MAPTCYP3A4ALOX15CHRM2 | |
| SCHEMBL9213796 | 0.87 | MTNR1A (0.41) | HCN4MAPTCYP3A4ALOX15CHRM2 |
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-0292840-B1 | Cyclic amine derivatives, medicaments containing these compounds and procedure for their preparation | THOMAE GMBH DR K (DE) | 1995-08-09 | — | — | EP | disclosed |
| EP-0292840-A2 | Cyclic amine derivatives, medicaments containing these compounds and procedure for their preparation | Dr. Karl Thomae GmbH (DE) | 1988-11-30 | — | — | EP | disclosed |