Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | MMP13 | P45452 | 2/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.38 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.38 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8209567 | 0.82 | KDM4E (0.47) | MEN1KMT2AHPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL8208820 | 0.81 | HPGD (0.45) | KMT2AHPGDALDH1A1SMN1; SMN2MMP13 | |
| SCHEMBL8198981 | 0.78 | PRKAA2 (0.44) | KMT2ASMN1; SMN2MMP13 | |
| SCHEMBL10077691 | 0.75 | HPGD (0.68) | MEN1KMT2AHPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL8205741 | 0.72 | PRKAA2 (0.44) | ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL8209165 | 0.70 | CYP2C9 (0.59) | MEN1KMT2ANOD2SMN1; SMN2CYP1A2 | |
| SCHEMBL107661 | 0.66 | P2RX7 (0.62) | MEN1KMT2AALDH1A1SMN1; SMN2KLKB1 | |
| SCHEMBL10710858 | 0.66 | CTSA (0.53) | MEN1KMT2AHPGDALDH1A1CTSA | |
| Hydrochloric Acid SCHEMBL10706070 | 0.65 | PDCD1LG2 (0.46) | MEN1KMT2AHPGDALDH1A1KLKB1 | |
| SCHEMBL16987767 | 0.65 | BRD4 (0.51) | MEN1KMT2ASMN1; SMN2CYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008082487-A2 | NOVEL JNK INHIBITORS | SCHERING CORPORATION (US) | 2008-07-10 | — | — | WO | disclosed |