Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 2/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | SCN4A | P35499 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29157407 | 0.82 | SCN4A (0.35) | KDM4ECYP3A4CYP2D6CYP1A2CYP2C19 | |
| SCHEMBL1653893 | 0.78 | GPR35 (0.39) | CYP3A4CYP2D6CYP1A2CYP2C19ELANE | |
| SCHEMBL7978485 | 0.73 | SMN1; SMN2 (0.44) | KDM4ECYP2D6CYP1A2CYP2C19ELANE | |
| SCHEMBL3499943 | 0.73 | SMN1; SMN2 (0.44) | KDM4ECYP2D6CYP1A2CYP2C19ELANE | |
| SCHEMBL7982064 | 0.73 | KDM4E (0.39) | KDM4EELANEPOLBTDP1HTR2C | |
| SCHEMBL27692446 | 0.73 | MAPT (0.42) | CYP1A2SLC6A3POLBTDP1L3MBTL1 | |
| SCHEMBL3835050 | 0.72 | ELANE (0.43) | CYP3A4CYP2D6CYP1A2CYP2C19ELANE | |
| SCHEMBL3499945 | 0.70 | CYP1A2 (0.46) | CYP2D6CYP1A2SLC6A3POLBTDP1 | |
| SCHEMBL16738853 | 0.70 | TDP1 (0.49) | KDM4EPOLBCTDSP1TDP1L3MBTL1 | |
| SCHEMBL30673293 | 0.70 | TDP1 (0.49) | KDM4EPOLBCTDSP1TDP1L3MBTL1 |
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-117263943-A | Selective inhibitors of poly (ADP-ribose) polymerase | 轩竹生物科技股份有限公司 | 2023-12-22 | — | — | CN | disclosed |