Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.83 |
| ▸ | LMNA | P02545 | 2/20 | 0.81 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.81 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.81 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.81 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.81 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.81 |
| ▸ | DRD2 | P14416 | 2/20 | 0.80 |
| ▸ | DRD1 | P21728 | 1/20 | 0.80 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.80 |
| ▸ | BCHE | P06276 | 1/20 | 0.80 |
| ▸ | ACHE | P22303 | 1/20 | 0.80 |
| ▸ | DRD4 | P21917 | 1/20 | 0.67 |
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 | |
|---|---|---|---|---|
| SCHEMBL21125881 | 1.00 | KCNH2 (0.83) | KCNH2LMNAKDM4EALDH1A1HSD17B10 | |
| SCHEMBL29641507 | 0.95 | DRD2 (0.80) | KCNH2LMNAKDM4EALDH1A1HSD17B10 | |
| SCHEMBL29373104 | 0.95 | DRD2 (0.89) | KCNH2LMNAKDM4EALDH1A1HSD17B10 | |
| Laudanidine SCHEMBL18187574 | 0.92 | DRD2 (0.95) | KCNH2LMNAKDM4EALDH1A1HSD17B10 | |
| Codamine SCHEMBL680513 | 0.92 | DRD2 (0.91) | KCNH2LMNAKDM4EALDH1A1HSD17B10 | |
| Laudanidine SCHEMBL30589210 | 0.92 | DRD2 (0.91) | KCNH2LMNAKDM4EALDH1A1HSD17B10 | |
| Laudanidine SCHEMBL15696580 | 0.92 | DRD2 (0.91) | KCNH2LMNAKDM4EALDH1A1HSD17B10 | |
| Codamine SCHEMBL30720053 | 0.92 | DRD2 (0.91) | KCNH2LMNAKDM4EALDH1A1HSD17B10 | |
| Codamine SCHEMBL15696578 | 0.92 | DRD2 (0.91) | KCNH2LMNAKDM4EALDH1A1HSD17B10 | |
| Laudanidine SCHEMBL679495 | 0.92 | DRD2 (0.91) | KCNH2LMNAKDM4EALDH1A1HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-9902699-B2 | Synthesis of tetrahydroisoquinolines from 2-methyl-1-phenyl substituted indenes | Gregory Rosocha (CA) | 2018-02-27 | — | — | US | disclosed |