Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 2/20 | 0.34 |
| ▸ | CRHBP | P24387 | 1/20 | 0.33 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | F3 | P13726 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
| ▸ | RBP1 | P09455 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10857643 | 0.82 | ALDH1A1 (0.42) | PARP1ALDH1A1CYP3A4MAPTKMT2A | |
| SCHEMBL11083684 | 0.75 | PARP1 (0.41) | PARP1ALDH1A1KDM4EHPGDPDE4A | |
| SCHEMBL8659379 | 0.70 | KDM1A (0.53) | PARP1CYP3A4LMNADRD2DRD1 | |
| SCHEMBL16924628 | 0.70 | KDM1A (0.53) | PARP1CYP3A4LMNADRD2DRD1 | |
| SCHEMBL6112924 | 0.70 | MAPT (0.45) | PARP1ABCB1CYP3A4CYP11B1CYP11B2 | |
| SCHEMBL3339321 | 0.69 | CRHBP (0.37) | ALDH1A1KDM4EHPGDCRHBPCRHR2 | |
| SCHEMBL16388051 | 0.69 | KDM1A (0.45) | CYP3A4 | |
| SCHEMBL12379988 | 0.69 | ABCB1 (0.45) | PARP1ALDH1A1KDM4EHPGDPDE4A | |
| SCHEMBL11006912 | 0.69 | PARP1 (0.43) | PARP1ALDH1A1KDM4EHPGDPDE4A | |
| SCHEMBL10723706 | 0.67 | ALDH1A1 (0.46) | PARP1ALDH1A1KDM4EHPGDPDE4A |
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-0069424-B1 | PROCESS FOR THE SELECTIVE REDUCTION OF A 14, 17-DIOXO-8,4-SECO-STEROID | AKZO N.V. (NL) | 1985-05-29 | — | — | EP | disclosed |