Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | BCHE | P06276 | 2/20 | 0.59 |
| ▸ | ACHE | P22303 | 2/20 | 0.59 |
| ▸ | PLAU | P00749 | 1/20 | 0.54 |
| ▸ | PARP1 | P09874 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | FAAH | O00519 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL1408989 | 0.91 | CYP1A2 (0.76) | KMT2ACYP1A2BCHEACHEPARP1 | |
| SCHEMBL6629002 | 0.86 | NPC1 (0.70) | KMT2ACYP1A2BCHEACHEALDH1A1 | |
| SCHEMBL12655119 | 0.85 | KMT2A (0.78) | KMT2ACYP1A2BCHEACHEALDH1A1 | |
| SCHEMBL10439393 | 0.85 | CYP1A2 (0.86) | KMT2ACYP1A2BCHEACHEALDH1A1 | |
| SCHEMBL9833721 | 0.84 | KMT2A (0.68) | KMT2ACYP1A2BCHEACHEALDH1A1 | |
| SCHEMBL30487931 | 0.84 | KMT2A (0.68) | KMT2ACYP1A2BCHEACHEALDH1A1 | |
| SCHEMBL1409910 | 0.83 | ALDH1A1 (0.66) | KMT2ACYP1A2ALDH1A1SMN1; SMN2GAA | |
| SCHEMBL27986104 | 0.83 | ALDH1A1 (0.66) | KMT2ACYP1A2PLAUALDH1A1SMN1; SMN2 | |
| Phenyl Phenylcarbamate SCHEMBL27565311 | 0.82 | ALDH1A1 (0.69) | KMT2ACYP1A2BCHEACHEALDH1A1 | |
| SCHEMBL9199240 | 0.81 | KMT2A (0.68) | KMT2ACYP1A2BCHEACHEALDH1A1 |
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-104230831-B | As PI3 kinases and the triaizine compounds of mTOR inhibitors | 惠氏有限责任公司 | 2016-08-24 | — | — | CN | disclosed |