Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 1/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.35 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | HTR1D | P28221 | 1/20 | 0.34 |
| ▸ | TYMS | P04818 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | METAP1 | P53582 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11518357 | 0.81 | MPO (0.50) | PARP1PARP10SIGMAR1ABCB1CYP19A1 | |
| SCHEMBL15660444 | 0.80 | HTR7 (0.44) | HTR7TAAR1CYP1A2SIGMAR1CYP19A1 | |
| SCHEMBL1289512 | 0.80 | SIGMAR1 (0.54) | HTR7TAAR1SIGMAR1ABCB1 | |
| Bromide SCHEMBL15662062 | 0.79 | HTR7 (0.43) | HTR7TAAR1CYP1A2SIGMAR1CYP19A1 | |
| Hydrochloric Acid SCHEMBL15662736 | 0.79 | HTR7 (0.43) | HTR7TAAR1CYP1A2CYP19A1HTR2A | |
| Hydrochloric Acid SCHEMBL1289495 | 0.78 | SIGMAR1 (0.53) | HTR7TAAR1SIGMAR1ABCB1 | |
| SCHEMBL10078250 | 0.78 | KDM4E (0.44) | PARP1PARP10 | |
| Hydrochloric Acid SCHEMBL8894987 | 0.76 | SIGMAR1 (0.49) | HTR7TAAR1CYP2A6SIGMAR1HTR2A | |
| SCHEMBL14302058 | 0.75 | PARP1 (0.38) | PARP1PARP10SIGMAR1CYP19A1CYP11B2 | |
| SCHEMBL23587249 | 0.72 | PARP10 (0.43) | PARP1PARP10CYP19A1CYP11B2TYMS |
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-2012046253-A2 | PROCESS FOR THE PREPARATION OF N-[2- (7-METHOXY-L-NAPHTHYL) ETHYL] ACETAMIDE AND ITS NOVEL CRYSTALLINE FORMS | MSN LABORATORIES LIMITED (IN) | 2012-04-12 | — | — | WO | disclosed |