Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CRHBP | P24387 | 1/20 | 0.39 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | FOS | P01100 | 1/20 | 0.38 |
| ▸ | JUN | P05412 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8694124 | 0.94 | ALDH1A1 (0.50) | ALDH1A1LMNAAGTR1KDM4ECREBBP | |
| SCHEMBL8698769 | 0.91 | ALDH1A1 (0.45) | ALDH1A1LMNAAGTR1KDM4ECREBBP | |
| SCHEMBL8696320 | 0.86 | ALDH1A1 (0.50) | ALDH1A1LMNAAGTR1KDM4ECREBBP | |
| SCHEMBL8696011 | 0.85 | KDM4E (0.40) | ALDH1A1KDM4ETSHRPOLBSMN1; SMN2 | |
| SCHEMBL8693715 | 0.85 | TEAD2 (0.40) | KDM4ETSHRPOLBSMN1; SMN2HDAC6 | |
| SCHEMBL8693505 | 0.85 | ALDH1A1 (0.49) | ALDH1A1LMNAAGTR1KDM4ECREBBP | |
| SCHEMBL8692534 | 0.85 | AGTR1 (0.49) | ALDH1A1LMNAAGTR1KDM4ECREBBP | |
| SCHEMBL8696343 | 0.83 | ALDH1A1 (0.47) | ALDH1A1LMNAAGTR1KDM4ECREBBP | |
| SCHEMBL8693064 | 0.82 | ALDH1A1 (0.52) | ALDH1A1LMNAAGTR1KDM4ECREBBP | |
| SCHEMBL8696191 | 0.81 | EPHX1 (0.47) | ALDH1A1LMNAAGTR1KDM4ECREBBP |
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 |
|---|---|---|---|---|---|---|---|
| US-5849779-A | Pyrazole derivatives and their pharmaceutical use | JAPAN ENERGY CORPORATION (JP) | 1998-12-15 | — | — | US | disclosed |
| EP-0810217-A1 | Pyrazole derivatives and their pharmaceutical use as smooth muscle cell growth inhibitors | JAPAN ENERGY CORPORATION (JP) | 1997-12-03 | — | — | EP | disclosed |