Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL23867468 | 0.91 | HRH3 (0.45) | HRH3LMNAMAPTMEN1KMT2A | |
| SCHEMBL23867472 | 0.89 | HRH3 (0.48) | HRH3LMNAMAPTMEN1KMT2A | |
| SCHEMBL23867473 | 0.88 | HCRTR1 (0.53) | SIGMAR1SLC2A1KDM4EHPGDHCRTR1 | |
| SCHEMBL30234700 | 0.85 | HRH3 (0.47) | HRH3LMNAMAPTMEN1KMT2A | |
| SCHEMBL23867524 | 0.82 | HCRTR1 (0.52) | HRH3LMNAMAPTMEN1KMT2A | |
| SCHEMBL30979651 | 0.81 | SLC2A1 (0.51) | HRH3LMNAMAPTMEN1KMT2A | |
| SCHEMBL31094227 | 0.81 | SLC2A1 (0.44) | HRH3LMNAMAPTMEN1KMT2A | |
| SCHEMBL23867576 | 0.78 | LMNA (0.52) | LMNAMAPTALDH1A1SLC2A1KDM4E | |
| SCHEMBL31094238 | 0.77 | SLC2A1 (0.50) | LMNAMAPTALDH1A1SLC2A1KDM4E | |
| SCHEMBL31094225 | 0.77 | CCNE1 (0.49) | LMNAMAPTALDH1A1KDM4EHPGD |
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 |