Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.35 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 5/20 | 0.33 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.32 |
| ▸ | FYN | P06241 | 2/20 | 0.31 |
| ▸ | SRC | P12931 | 2/20 | 0.31 |
| ▸ | FLT1 | P17948 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27306975 | 0.80 | SMN1; SMN2 (0.41) | KDM4EALDH1A1LMNAHPGDHTT | |
| SCHEMBL29133752 | 0.77 | HTT (0.36) | LMNAHTTEGFRIRAK4FLT1 | |
| SCHEMBL29133735 | 0.77 | HTT (0.36) | LMNAHTTEGFRIRAK4FLT1 | |
| SCHEMBL27697478 | 0.70 | KDM4E (0.47) | KDM4EALDH1A1LMNAHPGDHTT | |
| SCHEMBL27850019 | 0.70 | EGFR (0.48) | EGFR | |
| SCHEMBL7804103 | 0.66 | CYP1A2 (0.54) | KDM4EALDH1A1LMNAHPGDHTT | |
| SCHEMBL29133739 | 0.64 | HTT (0.50) | KDM4EALDH1A1LMNAHPGDMTOR | |
| SCHEMBL29133745 | 0.64 | HTT (0.50) | KDM4EALDH1A1LMNAHPGDMTOR | |
| SCHEMBL1584864 | 0.64 | IRAK4 (0.62) | ALDH1A1LMNAIRAK4 | |
| SCHEMBL17732838 | 0.63 | PARP1 (0.45) | KDM4EALDH1A1LMNAHPGDMTOR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101367794-B | Preparation method for quinazoline derivants and medical uses thereof | SHANGHAI HENGRUI PHARM CO LTD | 2013-07-10 | — | — | CN | disclosed |
| CN-101367794-A | Preparation method for quinazoline derivants and medical uses thereof | SHANGHAI HENGRUI PHARM CO LTD (CN) | 2009-02-18 | — | — | CN | disclosed |