Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | FUCA1 | P04066 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.34 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29471673 | 0.85 | RORC (0.41) | SMN1; SMN2GAA | |
| SCHEMBL16714596 | 0.69 | CYP19A1 (0.44) | TSHRCYP3A4CYP2C19MEN1KMT2A | |
| SCHEMBL26965338 | 0.67 | RIPK1 (0.41) | TSHRCYP2C19MEN1KMT2AALDH1A1 | |
| SCHEMBL28701185 | 0.67 | GRM6 (0.41) | TSHRMEN1KMT2AHSD11B1ALDH1A1 | |
| SCHEMBL22950454 | 0.65 | RORC (0.42) | — | |
| SCHEMBL20722495 | 0.64 | S1PR5 (0.49) | TSHRMEN1KMT2AHSD11B1FUCA1 | |
| SCHEMBL28612669 | 0.64 | AMPD2 (0.37) | TSHRCYP3A4MEN1KMT2ABRD4 | |
| SCHEMBL21682573 | 0.64 | AMPD2 (0.37) | TSHRCYP3A4MEN1KMT2ABRD4 | |
| SCHEMBL17685922 | 0.63 | BRD4 (0.52) | EHMT2BRD4 | |
| SCHEMBL15719254 | 0.62 | CTSL (0.40) | CYP2C19ALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114173787-A | Dihydropyrimidine derivatives and their use in the treatment of HBV infection or HBV-induced diseases | 杨森科学爱尔兰无限公司 | 2022-03-11 | — | — | CN | disclosed |