Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | HSD11B2 | P80365 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 6/20 | 0.38 |
| ▸ | MAOB | P27338 | 6/20 | 0.38 |
| ▸ | KDM1A | O60341 | 4/20 | 0.38 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18007733 | 0.75 | HSD11B1 (0.49) | KDM4EHPGDMAPK1NPSR1ALDH1A1 | |
| Bicarbonate SCHEMBL7575978 | 0.68 | HDAC4 (0.50) | KDM4EMAPTHPGDHDAC4SMN1; SMN2 | |
| SCHEMBL27163473 | 0.67 | MAPK1 (0.40) | MAPK1CYP2C19MAOAMAOBKDM1A | |
| Biphenyl SCHEMBL28946850 | 0.67 | MEN1 (0.55) | KDM4EMAPTHPGDMAPK1NPSR1 | |
| SCHEMBL7397920 | 0.65 | AKR1C3 (0.46) | MAPTMAPK1ALDH1A1CYP2C19MAOA | |
| SCHEMBL5435422 | 0.65 | MAPK1 (0.50) | MAPK1CYP2C19MAOAMAOBKDM1A | |
| SCHEMBL15754675 | 0.65 | CHRM1 (0.59) | MAPK1CYP2C19MAOAMAOBKDM1A | |
| SCHEMBL7549278 | 0.65 | CHRM1 (0.59) | MAPK1CYP2C19MAOAMAOBKDM1A | |
| SCHEMBL24609943 | 0.65 | DGAT1 (0.65) | KDM4EHSD11B1HSD11B2 | |
| Bicarbonate SCHEMBL7569185 | 0.64 | MEN1 (0.57) | KDM4EMAPTHPGDHDAC4SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6538002-B1 | In particular, these compounds are useful as modulators of the chemokine receptors CCR-5 and/or CCR-3. as antiinflammatory agents | MERCK & CO., INC. | 2003-03-25 | — | — | US | disclosed |
| US-6500844-B1 | PIPERIDINYL-1-METHYLCYCLOPENTANES AND STEREOISOMERS, USED AS ANTIINFLAMMATORY AND PROPHYLACTIC AGENTS AGAINST ALLERGIC RHINITIS, DERMATITIS, VISION DEFECTS, ASTHMA, ATHRITIS AND FOR PREVENTION OR DELAY OF AQUIRED IMMUNE DIFICIENCY SYNDROME | MERCK & CO., INC. | 2002-12-31 | — | — | US | disclosed |