Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 2/20 | 0.64 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.59 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.59 |
| ▸ | SLC6A12 | P48065 | 1/20 | 0.59 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | ACHE | P22303 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.55 |
| ▸ | DRD2 | P14416 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL8553564 | 0.95 | DRD4 (0.70) | DRD4SIGMAR1TMEM97SLC6A12MCHR1 | |
| SCHEMBL694949 | 0.82 | SIGMAR1 (0.82) | DRD4SIGMAR1TMEM97SLC6A12MCHR1 | |
| SCHEMBL4133414 | 0.82 | SIGMAR1 (0.67) | DRD4SIGMAR1ACHEKMT2ADPP7 | |
| SCHEMBL4298575 | 0.81 | SIGMAR1 (0.70) | DRD4SIGMAR1TMEM97SLC6A12MCHR1 | |
| SCHEMBL22634135 | 0.80 | SIGMAR1 (0.63) | DRD4SIGMAR1ACHEKMT2AMEN1 | |
| SCHEMBL8180075 | 0.79 | NPC1 (0.60) | KMT2AMEN1 | |
| SCHEMBL10559795 | 0.79 | CARM1 (0.48) | CYP2C9KMT2AMEN1 | |
| Bicarbonate SCHEMBL9236554 | 0.79 | TMEM97 (0.76) | DRD4SIGMAR1TMEM97SLC6A12MCHR1 | |
| SCHEMBL8185713 | 0.78 | CYP2C19 (0.62) | SIGMAR1CYP2D6CYP2C19KMT2AGAA | |
| SCHEMBL8786936 | 0.78 | DRD4 (1.00) | DRD4SIGMAR1TMEM97SLC6A12MCHR1 |
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-4841047-A | ANTIALLERGENS | AASTA PHARMA AG (DE) | 1989-06-20 | — | — | US | disclosed |
| EP-0222191-A1 | 4-Benzyl-1-2(H)-phthalazinone derivatives | ASTA Pharma AG (DE) | 1987-05-20 | — | — | EP | disclosed |