Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | KIF11 | P52732 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.42 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 2/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4327374 | 0.82 | KDM1A (0.41) | TSHRMAPTKDM1AMAOAMAOB | |
| SCHEMBL3286893 | 0.78 | MAOB (0.44) | ALDH1A1KIF11HTTKDM1AMAOA | |
| SCHEMBL3286887 | 0.78 | MAOB (0.44) | ALDH1A1KIF11HTTKDM1AMAOA | |
| SCHEMBL3286897 | 0.78 | MAOB (0.44) | ALDH1A1KIF11HTTKDM1AMAOA | |
| SCHEMBL27689109 | 0.77 | ALDH1A1 (0.43) | ALDH1A1TSHRKIF11HTTMAPT | |
| SCHEMBL4326057 | 0.75 | TSHR (0.43) | ALDH1A1TSHRHTTMAPTSMN1; SMN2 | |
| SCHEMBL4324752 | 0.75 | ALDH1A1 (0.43) | ALDH1A1TSHRKDM1AMAOAMAOB | |
| SCHEMBL21020916 | 0.73 | KDM1A (0.46) | MAPTKDM1ARCOR1HTR2AHTR2C | |
| SCHEMBL23848574 | 0.72 | MAOB (0.57) | ALDH1A1TSHRKIF11CYP3A4KDM1A | |
| SCHEMBL11303199 | 0.70 | HTT (0.39) | ALDH1A1HTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021188949-A1 | 3-DIARYLMETHYLENES AND USES THEREOF | ATUX ISKAY LLC (US) | 2021-09-23 | — | — | WO | disclosed |