Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 11/20 | 0.65 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.65 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | CASP3 | P42574 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11120445 | 0.82 | ALDH1A1 (0.68) | GRM2SLC9A1TDP1ALDH1A1 | |
| SCHEMBL22000732 | 0.80 | GRM2 (0.75) | GRM2SLC9A1TDP1LMNA | |
| SCHEMBL2734889 | 0.80 | GRM2 (1.00) | GRM2SLC9A1TDP1ALDH1A1KDM4E | |
| SCHEMBL14027284 | 0.78 | ALDH1A1 (0.63) | GRM2SLC9A1ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL7309399 | 0.78 | ALDH1A1 (0.63) | SLC9A1TDP1ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL7597659 | 0.77 | GRM2 (0.75) | GRM2SLC9A1TDP1KDM4ECYP2C9 | |
| SCHEMBL16398499 | 0.77 | GRM2 (0.75) | GRM2SLC9A1TDP1KDM4ELMNA | |
| SCHEMBL28345673 | 0.77 | GRM2 (0.75) | GRM2SLC9A1TDP1ALDH1A1KDM4E | |
| SCHEMBL16104116 | 0.74 | PTK2 (0.73) | GRM2SLC9A1TDP1ALDH1A1 | |
| SCHEMBL28514074 | 0.74 | GRM2 (0.65) | GRM2SLC9A1TDP1KDM4ELMNA |
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-2020113094-A1 | PYRROLE AND PYRAZOLE COMPOUNDS AND METHODS OF USE THEREOF | NUVATION BIO INC. (US) | 2020-06-04 | — | — | WO | disclosed |