Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 4/20 | 0.39 |
| ▸ | MAOB | P27338 | 4/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL21895900 | 0.81 | LMNA (0.42) | MAOAMAOBOPRM1OPRL1KDM4E | |
| SCHEMBL20630554 | 0.81 | LMNA (0.42) | MAOAMAOBOPRM1OPRL1KDM4E | |
| SCHEMBL6138472 | 0.69 | MAOA (0.48) | MAOAMAOBOPRM1OPRL1KDM4E | |
| Hydrochloric Acid SCHEMBL30175029 | 0.68 | MAOA (0.47) | MAOAMAOBOPRM1OPRL1KDM4E | |
| SCHEMBL14285983 | 0.67 | ADRB2 (0.48) | MAOAMAOBOPRM1OPRL1KDM4E | |
| SCHEMBL13075727 | 0.67 | MAOA (0.45) | MAOAMAOBOPRM1OPRL1KDM4E | |
| SCHEMBL27353392 | 0.65 | ADRB2 (0.50) | MAOAMAOBOPRM1OPRL1KDM4E | |
| SCHEMBL2374703 | 0.61 | MAOA (0.54) | MAOAMAOBOPRM1OPRL1CALM1 | |
| SCHEMBL506118 | 0.61 | MAOB (0.54) | MAOAMAOBOPRM1OPRL1CALM1 | |
| SCHEMBL28161193 | 0.61 | MAOA (0.48) | MAOAMAOBOPRM1OPRL1CALM1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3636807-A1 | CYCLIC PEPTIDE COMPOUND HAVING HIGH MEMBRANE PERMEABILITY, AND LIBRARY CONTAINING SAME | Chugai Seiyaku Kabushiki Kaisha (JP) | 2020-04-15 | — | — | EP | disclosed |