Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | STAT3 | P40763 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ELANE | P08246 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CCR2 | P41597 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.37 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | GLA | P06280 | 2/20 | 0.37 |
| ▸ | CRHBP | P24387 | 1/20 | 0.37 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27800832 | 0.77 | F2 (0.48) | ALDH1A1MAPK1ELANETDP1TSHR | |
| SCHEMBL27796324 | 0.69 | STAT3 (0.52) | ALDH1A1STAT3ELANETDP1TSHR | |
| SCHEMBL28702396 | 0.68 | KMT2A (0.40) | ALDH1A1ELANETDP1KMT2AKDM4E | |
| SCHEMBL5199685 | 0.68 | ALDH1A1 (0.46) | ALDH1A1STAT3MAPK1TDP1TSHR | |
| SCHEMBL7488560 | 0.67 | KDM4E (0.57) | ALDH1A1STAT3MAPK1TDP1TSHR | |
| SCHEMBL29057689 | 0.67 | KDM4E (0.49) | ALDH1A1TDP1KMT2AMEN1GAA | |
| SCHEMBL9381587 | 0.66 | EGFR (0.62) | ALDH1A1MAPK1TDP1TSHRKMT2A | |
| SCHEMBL9022394 | 0.66 | ALDH1A1 (0.47) | ALDH1A1STAT3MAPK1ELANETDP1 | |
| SCHEMBL2238063 | 0.65 | LMNA (0.54) | ALDH1A1MAPK1TDP1TSHRKMT2A | |
| SCHEMBL28691611 | 0.64 | CYP11B1 (0.41) | ALDH1A1KMT2AMEN1EGFRSRC |
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-101679251-B | (Aza)indole derivative and use thereof for medical purposes | KISSEI PHARMACEUTICAL | 2013-10-02 | — | — | CN | disclosed |
| CN-101679251-A | (Aza)indole derivative and use thereof for medical purposes | KISSEI PHARMACEUTICAL | 2010-03-24 | — | — | CN | disclosed |