Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | DRD2 | P14416 | 2/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 2/20 | 0.45 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 8/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 7/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6607240 | 0.98 | DRD2 (0.48) | ALDH1A1DRD2MAOAACHEMCHR1 | |
| SCHEMBL6235676 | 0.87 | CA2 (0.50) | MCHR1ADORA2AADORA1KDM4EMAPT | |
| SCHEMBL6231136 | 0.85 | LMNA (0.50) | DRD2MAOAMCHR1KDM4EMAPT | |
| SCHEMBL6251149 | 0.81 | DRD4 (0.50) | ALDH1A1DRD2MCHR1KDM4EMAPT | |
| SCHEMBL10238584 | 0.80 | FAAH (0.56) | DRD2DRD4DRD3FAAH | |
| SCHEMBL6232410 | 0.79 | MCHR1 (0.49) | ALDH1A1DRD2MCHR1KDM4EHTT | |
| SCHEMBL6607124 | 0.74 | ALDH1A1 (0.56) | ALDH1A1KDM4EMAPTHTTTDP1 | |
| SCHEMBL24601455 | 0.72 | CYP2A6 (0.58) | ALDH1A1KDM4EMAPTTDP1 | |
| SCHEMBL23612352 | 0.72 | BACE1 (0.41) | ALDH1A1KDM4EMAPTTDP1 | |
| SCHEMBL2924832 | 0.71 | ALDH1A1 (0.68) | ALDH1A1DRD2MAOAACHEKDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004092181-A9 | HETEROCYCLIC MCHR1 ANTAGONISTS | SMITHKLINE BEECHAM CORP (US) | 2005-01-27 | — | — | WO | disclosed |