Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | VHL | P40337 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4031821 | 1.00 | MEN1 (0.46) | MEN1KMT2AALDH1A1NPBWR1MCHR1 | |
| SCHEMBL4034144 | 0.77 | SMN1; SMN2 (0.35) | ALDH1A1LMNASMN1; SMN2CA2CA1 | |
| SCHEMBL4034149 | 0.77 | SMN1; SMN2 (0.35) | ALDH1A1LMNASMN1; SMN2CA2CA1 | |
| SCHEMBL3852796 | 0.76 | CA12 (0.42) | ALDH1A1LMNARAB9AHPGDSMN1; SMN2 | |
| SCHEMBL3852793 | 0.76 | CA12 (0.42) | ALDH1A1LMNARAB9AHPGDSMN1; SMN2 | |
| SCHEMBL4032553 | 0.73 | CYP2C9 (0.58) | MEN1KMT2AALDH1A1LMNARAB9A | |
| SCHEMBL4032550 | 0.73 | CYP2C9 (0.58) | MEN1KMT2AALDH1A1LMNARAB9A | |
| SCHEMBL3853725 | 0.71 | SMN1; SMN2 (0.32) | SMN1; SMN2CA2 | |
| SCHEMBL3853730 | 0.71 | SMN1; SMN2 (0.32) | SMN1; SMN2CA2 | |
| SCHEMBL20066498 | 0.69 | MEN1 (0.54) | MEN1KMT2AALDH1A1NPBWR1MCHR1 |
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-1678169-B1 | 4-(PYRAZOL-3-YLAMINO)PYRIMIDINE DERIVATIVES FOR USE IN THE TREATMENT OF CANCER | ASTRAZENECA AB (SE) | 2009-07-22 | — | — | EP | disclosed |