Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 1/20 | 0.58 |
| ▸ | CAMK2B | Q13554 | 1/20 | 0.58 |
| ▸ | MAP2K1 | Q02750 | 19/20 | 0.56 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.51 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.51 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.51 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.51 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL15129748 | 0.92 | MAP2K1 (0.67) | MAP2K1MAP2K2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL15129746 | 0.91 | MAP2K1 (0.52) | PIM1CAMK2BMAP2K1MAP2K2CYP3A4 | |
| SCHEMBL16305603 | 0.86 | MEN1 (0.60) | PIM1CAMK2BMAP2K1MAP2K2CYP3A4 | |
| SCHEMBL19367389 | 0.86 | PIM1 (0.58) | PIM1CAMK2BMAP2K1MAP2K2HDAC3 | |
| SCHEMBL15129745 | 0.85 | MAP2K1 (0.69) | MAP2K1MAP2K2 | |
| SCHEMBL15130253 | 0.85 | MAP2K1 (0.48) | PIM1CAMK2BMAP2K1MAP2K2CYP3A4 | |
| SCHEMBL15131443 | 0.84 | MAP2K1 (0.62) | PIM1CAMK2BMAP2K1MAP2K2CYP3A4 | |
| SCHEMBL15129550 | 0.83 | MAP2K1 (0.53) | PIM1CAMK2BMAP2K1MAP2K2CYP3A4 | |
| SCHEMBL19366603 | 0.83 | MAP2K1 (0.53) | MAP2K1MAP2K2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL19366620 | 0.83 | MAP2K1 (0.43) | PIM1CAMK2BMAP2K1MAP2K2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2804855-B1 | BENZOHETEROCYCLIC COMPOUNDS AND USE THEREOF | SHANGHAI KECHOW PHARMA INC (CN) | 2017-09-20 | — | — | EP | disclosed |