Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.51 |
| ▸ | AURKA | O14965 | 1/20 | 0.51 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.51 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.51 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.51 |
| ▸ | ABL1 | P00519 | 1/20 | 0.51 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.51 |
| ▸ | CSF1R | P07333 | 1/20 | 0.51 |
| ▸ | RET | P07949 | 1/20 | 0.51 |
| ▸ | MET | P08581 | 1/20 | 0.51 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.51 |
| ▸ | PIM1 | P11309 | 1/20 | 0.51 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.51 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.51 |
| ▸ | FLT1 | P17948 | 1/20 | 0.51 |
| ▸ | LTK | P29376 | 1/20 | 0.51 |
| ▸ | GRK5 | P34947 | 1/20 | 0.51 |
| ▸ | KDR | P35968 | 1/20 | 0.51 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.51 |
| ▸ | FLT3 | P36888 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL31380861 | 0.85 | PDE3B (0.47) | TDP2PDE3BPDE3AMAPTNPC1 | |
| SCHEMBL13873057 | 0.79 | MAPT (0.44) | TDP2PDE3BPDE3AMAPTNPC1 | |
| SCHEMBL5063150 | 0.78 | PDE3B (0.42) | CHEK1AURKADAPK3PRKD3MAP4K4 | |
| SCHEMBL21053191 | 0.78 | PDE3B (0.42) | CHEK1AURKADAPK3PRKD3MAP4K4 | |
| SCHEMBL16268739 | 0.73 | NOX1 (0.45) | CHEK1AURKADAPK3PRKD3MAP4K4 | |
| SCHEMBL21834865 | 0.72 | PDE2A (0.44) | GSK3BTDP2PDE3BPDE3AMAPT | |
| SCHEMBL22509833 | 0.72 | CYP11B1 (0.45) | MAPTKMT2AALDH1A1GLAHPGD | |
| SCHEMBL5766425 | 0.71 | KDR (0.54) | CHEK1AURKADAPK3PRKD3MAP4K4 | |
| SCHEMBL30796831 | 0.71 | AHR (0.59) | TDP2PDE3BPDE3ANPC1GAA | |
| Acridine SCHEMBL28171509 | 0.71 | ALDH1A1 (0.60) | GSK3BTDP2PDE3BPDE3AMAPT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020119212-A1 | NITROIMIDAZOLE DERIVATIVE, PREPARATION AND USES THEREOF | 诺沃斯达药业有限公司 | 2020-06-18 | — | — | WO | disclosed |
| EP-0707586-B1 | POSITIVE INOTROPIC AND LUSITROPIC PYRROLOQUINOLINONE DERIVATIVES | JANSSEN PHARMACEUTICA NV (BE) | 1998-09-16 | — | — | EP | disclosed |
| US-5602134-A | USEFUL FOR TREATING ANIMALS SUFFERING FROM CONGESTIVE HEART FAILURE | JANSSEN PHARMACEUTICA N.V. (BE) | 1997-02-11 | — | — | US | disclosed |
| EP-0707586-A1 | POSITIVE INOTROPIC AND LUSITROPIC PYRROLOQUINOLINONE DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 1996-04-24 | — | — | EP | disclosed |
| WO-1995000512-A1 | POSITIVE INOTROPIC AND LUSITROPIC PYRROLOQUINOLINONE DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 1995-01-05 | — | — | WO | disclosed |