Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.45 |
| ▸ | PDE2A | O00408 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 2/20 | 0.41 |
| ▸ | PDE5A | O76074 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.40 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.40 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.40 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL22736815 | 0.79 | CRHR1 (0.44) | PDE10AMEN1KMT2ACYP1A1CYP1A2 | |
| SCHEMBL22720128 | 0.76 | KDM4E (0.51) | MEN1KMT2ACYP1A2ALDH1A1SMN1; SMN2 | |
| SCHEMBL12788497 | 0.69 | SMN1; SMN2 (0.51) | CYP1A1CYP1A2CYP1B1PDE5AALDH1A1 | |
| SCHEMBL1463739 | 0.68 | CYP1A2 (0.49) | PDE10AMEN1KMT2ACYP1A1CYP1A2 | |
| SCHEMBL1463588 | 0.68 | KCNH2 (0.52) | MEN1KMT2ACYP1A1CYP1A2CYP1B1 | |
| SCHEMBL1463663 | 0.67 | KCNH2 (0.59) | MEN1KMT2ACYP1A1CYP1A2CYP1B1 | |
| SCHEMBL7825423 | 0.66 | TP53 (0.51) | MEN1KMT2AALDH1A1SMN1; SMN2TP53 | |
| SCHEMBL7458826 | 0.65 | TP53 (0.60) | MEN1KMT2AALDH1A1SMN1; SMN2TP53 | |
| SCHEMBL1463838 | 0.65 | KCNH2 (0.60) | CYP1A2EGFRALDH1A1KDM4E | |
| SCHEMBL1663473 | 0.65 | LMNA (0.63) | PDE10AMEN1KMT2ACYP1A2ALDH1A1 |
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-2020239050-A1 | 2-(2-CHLORO-4-METHYLPHENYL)QUINAZOLINE-4(3H)-KETONE COMPOUND AND MEDICAL USE THEREOF | 中国人民解放军军事科学院军事医学研究院 | 2020-12-03 | — | — | WO | disclosed |