Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | GSK3A | P49840 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.33 |
| ▸ | CSNK1G1 | Q9HCP0 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.31 |
| ▸ | CLK2 | P49760 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6588035 | 0.79 | PIM1 (0.38) | KDM4ESMN1; SMN2CYP1A2PIM1GSK3A | |
| SCHEMBL4717958 | 0.65 | KDM4E (0.57) | KDM4ESMN1; SMN2CYP1A2GSK3BKCNH2 | |
| SCHEMBL29433780 | 0.65 | KDM4E (0.57) | KDM4ESMN1; SMN2CYP1A2GSK3BKCNH2 | |
| SCHEMBL10730540 | 0.64 | KCNH2 (0.52) | PIM1GSK3AGSK3BPIM3CSNK1G1 | |
| SCHEMBL9457173 | 0.62 | KCNH2 (0.42) | KDM4EPIM1GSK3AGSK3BPIM3 | |
| SCHEMBL31071660 | 0.62 | KDM4E (0.50) | KDM4ESMN1; SMN2CYP1A2GSK3BKCNH2 | |
| SCHEMBL31071659 | 0.62 | KDM4E (0.50) | KDM4ESMN1; SMN2CYP1A2GSK3BKCNH2 | |
| SCHEMBL4368309 | 0.61 | KDM4E (0.75) | KDM4EKCNH2POLBPRKD3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL4466832 | 0.61 | PIM1 (0.36) | KDM4ESMN1; SMN2CYP1A2PIM1GSK3A | |
| SCHEMBL4713048 | 0.61 | KDM4E (0.52) | KDM4ESMN1; SMN2CYP1A2GSK3BKCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1392677-A2 | CHIRAL BROAD-SPECTRUM ANTIBACTERIAL 7-SUBSTITUTED PIPERIDINO-QUINOLONE CARBOXYLIC ACID DERIVATIVES, THEIR PREPARATION AND COMPOSITIONS | Wockhardt Limited (IN) | 2004-03-03 | — | — | EP | disclosed |
| WO-2002085886-A2 | CHIRAL, BROAD-SPECTRUM ANTIBACTERIAL 7-SUBSTITUTED PIPERIDINO-QUINOLONE CARBOXYLIC ACID DERIVATIVES, THEIR PREPARATION AND COMPOSITIONS | WOCKHARDT LIMITED (IN) | 2002-10-31 | — | — | WO | disclosed |