Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.35 |
| ▸ | NSD2 | O96028 | 2/20 | 0.32 |
| ▸ | CASP6 | P55212 | 2/20 | 0.32 |
| ▸ | PDE2A | O00408 | 1/20 | 0.32 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.31 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.31 |
| ▸ | CCR1 | P32246 | 2/20 | 0.31 |
| ▸ | CCR5 | P51681 | 2/20 | 0.31 |
| ▸ | CCR8 | P51685 | 2/20 | 0.31 |
| ▸ | CYP1A1 | P04798 | 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 | |
|---|---|---|---|---|
| SCHEMBL3929993 | 0.77 | ROCK2 (0.35) | ACVR1NSD2CASP6PDE10AHSP90AA1 | |
| SCHEMBL3375976 | 0.77 | CCR1 (0.49) | KDM4EMAPK1NPSR1ACVR1NSD2 | |
| SCHEMBL3375901 | 0.75 | CCR1 (0.38) | KDM4EACVR1NSD2CASP6PDE2A | |
| SCHEMBL5506908 | 0.73 | SLC10A1 (0.38) | ACVR1PDE2APDE10ALMNA | |
| SCHEMBL6447631 | 0.73 | CHRM2 (0.41) | CHRM2CHRM1CHRM3LMNACYP1A1 | |
| SCHEMBL20551265 | 0.73 | CHRM2 (0.41) | CHRM2CHRM1CHRM3LMNACYP1A1 | |
| SCHEMBL4279169 | 0.72 | NOS3 (0.43) | KDM4EACVR1NSD2CASP6PDE2A | |
| SCHEMBL2923376 | 0.72 | NOS3 (0.40) | KDM4EMAPK1NPSR1ACVR1NSD2 | |
| SCHEMBL18544288 | 0.72 | CCR1 (0.38) | KDM4EACVR1NSD2CASP6PDE2A | |
| SCHEMBL3403559 | 0.72 | NSD2 (0.35) | KDM4EMAPK1NSD2CASP6LMNA |
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-1305308-A1 | AMINOPIPERIDINE QUINOLINES AND THEIR AZAISOSTERIC ANALOGUES WITH ANTIBACTERIAL ACTIVITY | SMITHKLINE BEECHAM PLC (GB) | 2003-05-02 | — | — | EP | disclosed |
| WO-2002008224-A1 | AMINOPIPERIDINE QUINOLINES AND THEIR AZAISOSTERIC ANALOGUES WITH ANTIBACTERIAL ACTIVITY | SMITHKLINE BEECHAM P.L.C. (GB) | 2002-01-31 | — | — | WO | disclosed |