Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CREBBP | Q92793 | 2/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | RAD52 | P43351 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CCR2 | P41597 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.33 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | TACR3 | P29371 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2486158 | 0.90 | CREBBP (0.36) | CREBBPBRD4LMNAKDM4EP2RX7 | |
| SCHEMBL2485028 | 0.81 | P2RX7 (0.40) | CREBBPBRD4LMNAP2RX7ROCK2 | |
| SCHEMBL2510242 | 0.79 | BRD4 (0.38) | CREBBPBRD4MEN1RAD52KMT2A | |
| Trifluoroacetic Acid SCHEMBL2487274 | 0.75 | SMYD2 (0.32) | KDM4EROCK2 | |
| SCHEMBL12315754 | 0.74 | ALDH1A1 (0.34) | LMNAKDM4EROCK2 | |
| SCHEMBL2487774 | 0.73 | CKS1B (0.47) | CREBBPBRD4LMNA | |
| SCHEMBL2485351 | 0.72 | ALDH1A1 (0.36) | KDM4EROCK2 | |
| SCHEMBL2490206 | 0.71 | HCRTR2 (0.40) | LMNAKMT2AKDM4E | |
| SCHEMBL2805666 | 0.71 | SMYD2 (0.41) | CCR2TDP1 | |
| Trifluoroacetic Acid SCHEMBL2487091 | 0.70 | DPP8 (0.35) | ROCK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2379551-A1 | SUBSTITUTED PYRAZOLO [3, 4-B]PYRIDINE COMPOUNDS | ArQule, Inc. (US) | 2011-10-26 | — | — | EP | disclosed |
| WO-2010078427-A1 | SUBSTITUTED PYRAZOLO [3, 4-B] PYRIDINE COMPOUNDS | ARQULE, INC. (US) | 2010-07-08 | — | — | WO | disclosed |