Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALKBH3 | Q96Q83 | 2/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6047653 | 0.85 | HSD11B1 (0.37) | MAPTCYP1A2CYP2C19CCKAR | |
| SCHEMBL5887404 | 0.85 | L3MBTL1 (0.40) | ACHEMAPTKDM4EMAOBALDH1A1 | |
| SCHEMBL5887443 | 0.85 | ACHE (0.46) | ALKBH3ACHEMAPTNPSR1RAB9A | |
| SCHEMBL5887672 | 0.83 | ESR2 (0.40) | SMN1; SMN2 | |
| SCHEMBL6047624 | 0.77 | ESR1 (0.35) | MAPTKDM4ECYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL8201027 | 0.73 | DYRK1A (0.39) | MAPTNPSR1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL25873212 | 0.73 | ALKBH3 (0.65) | ALKBH3ACHEMAPTNPSR1KDM4E | |
| SCHEMBL1047258 | 0.73 | ALKBH3 (0.65) | ALKBH3ACHEMAPTNPSR1KDM4E | |
| SCHEMBL4010238 | 0.73 | CACNA2D1 (0.47) | MAPTKDM4ERAB9ANPC1ALDH1A1 | |
| SCHEMBL12871361 | 0.71 | ABL1 (0.63) | ALKBH3ACHEMAPTNPSR1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-7037931-B2 | Corticotropin releasing factor moderator; analgesics; drug abruse, drug dependency; schizophrenia | JANSSEN PHARMACEUTICA N.V. (BE) | 2006-05-02 | — | — | US | claimed |