Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 2/20 | 0.42 |
| ▸ | CCNE1 | P24864 | 6/20 | 0.41 |
| ▸ | CDK2 | P24941 | 6/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | GALR2 | O43603 | 2/20 | 0.38 |
| ▸ | GALR1 | P47211 | 1/20 | 0.38 |
| ▸ | KIF18A | Q8NI77 | 2/20 | 0.38 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL23867526 | 0.82 | CCNE1 (0.48) | LMNAHSD17B10ALDH1A1KDM4EHPGD | |
| SCHEMBL30234364 | 0.82 | CCNE1 (0.48) | LMNAHSD17B10ALDH1A1KDM4EHPGD | |
| SCHEMBL30165660 | 0.78 | CCNE1 (0.43) | LMNAHSD17B10ALDH1A1KDM4EHPGD | |
| SCHEMBL23859943 | 0.74 | HRH3 (0.53) | LMNAHSD17B10ALDH1A1KDM4EHPGD | |
| SCHEMBL30165658 | 0.74 | HRH3 (0.53) | LMNAHSD17B10ALDH1A1KDM4EHPGD | |
| SCHEMBL23867469 | 0.72 | CCNE1 (0.45) | LMNAHSD17B10ALDH1A1KDM4EHPGD | |
| SCHEMBL30234371 | 0.71 | ROCK1 (0.46) | LMNAHSD17B10ALDH1A1KDM4EHPGD | |
| SCHEMBL17782347 | 0.69 | NR4A2 (0.62) | LMNAHSD17B10ALDH1A1KDM4EMAPT | |
| SCHEMBL18832024 | 0.69 | ALDH1A1 (0.52) | LMNAALDH1A1MAPT | |
| SCHEMBL23859942 | 0.68 | POLB (0.55) | LMNAHSD17B10ALDH1A1KDM4EHPGD |
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-2021195279-A2 | SMALL MOLECULE INHIBITORS OF ONCOGENIC CHD1L WITH PRECLINICAL ACTIVITY AGAINST COLORECTAL CANCER | THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) | 2021-09-30 | — | — | WO | disclosed |