Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28452508 | 0.87 | ALDH1A1 (0.47) | ALDH1A1MEN1KMT2ACA12CA9 | |
| SCHEMBL28529020 | 0.81 | MMP2 (0.54) | ALDH1A1MEN1KMT2ACYP1A2CYP3A4 | |
| SCHEMBL28450118 | 0.80 | ALDH1A1 (0.45) | ALDH1A1MEN1KMT2ACA12CA9 | |
| SCHEMBL28461694 | 0.77 | ALDH1A1 (0.42) | ALDH1A1MEN1KMT2ACA12CA9 | |
| SCHEMBL28530379 | 0.74 | ALDH1A1 (0.56) | ALDH1A1MEN1KMT2ACA12CA9 | |
| SCHEMBL20512270 | 0.74 | ALDH1A1 (0.55) | ALDH1A1MEN1KMT2ACA12CA9 | |
| SCHEMBL812658 | 0.72 | USP2 (0.69) | ALDH1A1MEN1KMT2ACYP1A2CYP3A4 | |
| SCHEMBL5567042 | 0.72 | ALDH1A1 (0.75) | ALDH1A1MEN1KMT2ACYP1A2CYP3A4 | |
| SCHEMBL6020322 | 0.71 | ALDH1A1 (0.60) | ALDH1A1MEN1KMT2ACA12CA9 | |
| SCHEMBL20512257 | 0.71 | ALDH1A1 (0.60) | ALDH1A1MEN1KMT2ACYP1A2CYP3A4 |
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-108299423-B | Synthesis method of dihydropyrrolo-2-aminoquinoline compound | 华南理工大学 | 2020-09-22 | — | — | CN | disclosed |