Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP2K1 | Q02750 | 17/20 | 0.64 |
| ▸ | MAP2K2 | P36507 | 3/20 | 0.64 |
| ▸ | CSNK2A2 | P19784 | 2/20 | 0.64 |
| ▸ | SMC2 | O95347 | 1/20 | 0.64 |
| ▸ | EGFR | P00533 | 1/20 | 0.64 |
| ▸ | SMC1A | Q14683 | 1/20 | 0.64 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.64 |
| ▸ | Q6ZSR9 | Q6ZSR9 | 1/20 | 0.64 |
| ▸ | BMP2K | Q9NSY1 | 1/20 | 0.64 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.56 |
| ▸ | NQO2 | P16083 | 1/20 | 0.56 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8063828 | 0.98 | MAP2K1 (0.63) | MAP2K1MAP2K2CSNK2A2SMC2EGFR | |
| SCHEMBL8213744 | 0.97 | MAP2K1 (0.62) | MAP2K1MAP2K2CSNK2A2SMC2EGFR | |
| SCHEMBL8071565 | 0.96 | MAP2K1 (0.66) | MAP2K1MAP2K2CSNK2A2SMC2EGFR | |
| SCHEMBL8064111 | 0.96 | MAP2K1 (0.68) | MAP2K1MAP2K2CSNK2A2SMC2EGFR | |
| SCHEMBL8071563 | 0.93 | MAP2K1 (0.67) | MAP2K1MAP2K2CSNK2A2SMC2EGFR | |
| SCHEMBL8064112 | 0.93 | MAP2K1 (0.66) | MAP2K1MAP2K2CSNK2A2SMC2EGFR | |
| SCHEMBL14067369 | 0.92 | MAP2K1 (0.76) | MAP2K1MAP2K2CSNK2A2SMC2EGFR | |
| SCHEMBL14067379 | 0.90 | MAP2K1 (0.75) | MAP2K1MAP2K2CSNK2A2SMC2EGFR | |
| SCHEMBL8070128 | 0.89 | MAP2K1 (0.65) | MAP2K1MAP2K2CSNK2A2SMC2EGFR | |
| SCHEMBL8064131 | 0.89 | MAP2K1 (0.74) | MAP2K1MAP2K2CSNK2A2SMC2EGFR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009036020-A1 | MEK INHIBITORS CONTAINING A ZINC BINDING MOIETY | CURIS, INC. (US) | 2009-03-19 | — | — | WO | disclosed |
| WO-2008033747-A9 | MULTI-FUNCTIONAL SMALL MOLECULES AS ANTI-PROLIFERATIVE AGENTS | CURIS INC (MA) | 2008-07-24 | — | — | WO | disclosed |
| WO-2008033747-A2 | MULTI-FUNCTIONAL SMALL MOLECULES AS ANTI-PROLIFERATIVE AGENTS | CURIS, INC. (US) | 2008-03-20 | — | — | WO | disclosed |