Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | ATG7 | O95352 | 3/20 | 0.39 |
| ▸ | UBA6 | A0AVT1 | 1/20 | 0.39 |
| ▸ | UBA7 | P41226 | 1/20 | 0.39 |
| ▸ | NAE1 | Q13564 | 1/20 | 0.39 |
| ▸ | UBA3 | Q8TBC4 | 1/20 | 0.39 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ALB | P02768 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.35 |
| ▸ | DNPH1 | O43598 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12566844 | 0.88 | BCHE (0.44) | BCHECYP1A2ATG7UBA6UBA7 | |
| SCHEMBL12566802 | 0.88 | BCHE (0.44) | BCHECYP1A2ATG7UBA6UBA7 | |
| SCHEMBL12567213 | 0.86 | BCHE (0.43) | BCHECYP1A2ATG7UBA6UBA7 | |
| SCHEMBL12566427 | 0.85 | DNPH1 (0.47) | BCHECYP1A2ATG7UBA6UBA7 | |
| SCHEMBL12566878 | 0.85 | BCHE (0.42) | BCHECYP1A2ATG7UBA6UBA7 | |
| SCHEMBL12566833 | 0.82 | BCHE (0.41) | BCHECYP1A2ATG7UBA6UBA7 | |
| SCHEMBL12566836 | 0.80 | ATG7 (0.56) | ATG7UBA6UBA7NAE1UBA3 | |
| SCHEMBL12567198 | 0.79 | ATG7 (0.46) | BCHECYP1A2ATG7UBA6UBA7 | |
| SCHEMBL13773372 | 0.79 | BCHE (0.54) | BCHECYP1A2ALDH1A1LMNAALB | |
| SCHEMBL12652416 | 0.79 | DNPH1 (0.43) | BCHECYP1A2ATG7UBA6UBA7 |
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 |
|---|---|---|---|---|---|---|---|
| US-7951810-B2 | Substituted pyrrolo[2,3-d]pyrimidines as inhibitors of E1 activating enzymes | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2011-05-31 | — | — | US | disclosed |