Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | NMT2 | O60551 | 1/20 | 0.42 |
| ▸ | NMT1 | P30419 | 1/20 | 0.42 |
| ▸ | APP | P05067 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | TDO2 | P48775 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4617058 | 0.86 | DRD2 (0.50) | DRD2ADRA1AKDM4EKMT2AALDH1A1 | |
| SCHEMBL5325602 | 0.83 | NMT2 (0.43) | NMT2NMT1APPIDO1TDO2 | |
| SCHEMBL5512313 | 0.82 | HTR2C (0.48) | KMT2AALDH1A1 | |
| SCHEMBL4775482 | 0.81 | WDR5 (0.41) | KDM4ENMT2NMT1 | |
| SCHEMBL27893573 | 0.81 | NMT2 (0.50) | KMT2AALDH1A1NMT2NMT1APP | |
| SCHEMBL27621992 | 0.80 | NMT2 (0.50) | KDM4EKMT2AALDH1A1NMT2NMT1 | |
| Hydrochloric Acid SCHEMBL2034993 | 0.80 | NMT2 (0.42) | NMT2NMT1APPCYP1A2CYP2C9 | |
| Hydrochloric Acid SCHEMBL27873356 | 0.80 | NMT2 (0.49) | KMT2ANMT2NMT1APPMEN1 | |
| SCHEMBL4764984 | 0.78 | NAMPT (0.56) | — | |
| SCHEMBL4764955 | 0.77 | DRD2 (0.54) | DRD2ADRA1AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007114902-A2 | ALKYLTHIOBENZYLPIPERIDINE COMPOUNDS | H.LUNDBECK A/S (DK) | 2007-10-11 | — | — | WO | disclosed |
| CN-1735595-A | Substituted alkyl amido piperidines | LUNDBECK & CO AS H (DK) | 2006-02-15 | — | — | CN | disclosed |