Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 7/20 | 0.54 |
| ▸ | MEN1 | O00255 | 5/20 | 0.54 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29190601 | 1.00 | KMT2A (0.54) | KMT2AMEN1NLRP3ALDH1A1CYP1A2 | |
| SCHEMBL26778543 | 0.92 | ALDH1A1 (0.51) | KMT2AMEN1NLRP3ALDH1A1CYP1A2 | |
| SCHEMBL14591325 | 0.78 | ALOX12 (0.56) | KMT2AMEN1ALDH1A1HTTKDM4E | |
| SCHEMBL30871992 | 0.78 | CYP1A2 (0.54) | KMT2AMEN1ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL29190645 | 0.77 | CES1 (0.45) | KMT2AMEN1NLRP3ALDH1A1HTT | |
| SCHEMBL30833729 | 0.77 | CES1 (0.45) | KMT2AMEN1NLRP3ALDH1A1HTT | |
| SCHEMBL19603146 | 0.75 | RAB9A (0.41) | KMT2AMEN1NLRP3ALDH1A1HTT | |
| SCHEMBL25014052 | 0.75 | KMT2A (0.42) | KMT2AMEN1ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL29216430 | 0.75 | NOTUM (0.52) | KMT2AMEN1ALDH1A1HTTHPGD | |
| SCHEMBL16284295 | 0.73 | HTR2A (0.44) | KMT2AMEN1ALDH1A1CYP1A2CYP2C9 |
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-113896744-B | Selective EGFR inhibitor | 成都先导药物开发股份有限公司 | 2024-04-16 | — | — | CN | disclosed |
| CN-117794914-A | Pyrimidine-2, 4-diamine derivatives, process for preparing the same, and pharmaceutical composition for preventing or treating cancer comprising the same as active ingredient | 韩国化学研究院 | 2024-03-29 | — | — | CN | disclosed |