Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK3 | P52333 | 4/20 | 0.43 |
| ▸ | BTK | Q06187 | 4/20 | 0.43 |
| ▸ | EGFR | P00533 | 3/20 | 0.43 |
| ▸ | ITK | Q08881 | 2/20 | 0.43 |
| ▸ | MAPK3 | P27361 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | BCR | P11274 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 2/20 | 0.40 |
| ▸ | BLK | P51451 | 2/20 | 0.40 |
| ▸ | BMX | P51813 | 2/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16104950 | 0.89 | TGM2 (0.46) | JAK3BTKMAPK3MAPTCYP1A2 | |
| Pyridine SCHEMBL27849477 | 0.77 | TGM2 (0.59) | EGFRITKMAPTCYP2C9MEN1 | |
| SCHEMBL31596078 | 0.77 | CYP1A2 (0.56) | EGFRMAPK3MAPTCYP1A2CYP2C9 | |
| SCHEMBL24132024 | 0.77 | EGFR (0.48) | JAK3BTKEGFRITKMTOR | |
| SCHEMBL10054789 | 0.75 | NAMPT (0.54) | EGFRMAPT | |
| SCHEMBL11289487 | 0.75 | MAPT (0.51) | MAPTCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL2679766 | 0.74 | HDAC3 (0.46) | BTKEGFRCYP1A2 | |
| SCHEMBL2679758 | 0.74 | HDAC3 (0.46) | BTKEGFRCYP1A2 | |
| SCHEMBL21894170 | 0.74 | TGM2 (0.58) | MAPK3MAPTCYP1A2CYP2C19MEN1 | |
| SCHEMBL31162390 | 0.74 | TGM2 (0.58) | MAPK3MAPTCYP1A2CYP2C19MEN1 |
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-102421754-B | Acrylamide derivative and use thereof in manufacture of medicament | BEIJING SHIQIAO BIOPHAM CO LTD | 2013-11-27 | — | — | CN | disclosed |
| CN-102421754-A | Acrylamide derivative and use thereof in manufacture of medicament | BEIJING JIASHILIANBO PHARM SCI & TECH CO LTD | 2012-04-18 | — | — | CN | disclosed |