Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | MC4R | P32245 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.30 |
| ▸ | TACR1 | P25103 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9199405 | 0.93 | HTR2A (0.35) | HTR2AHRH1MAPTHTTNPSR1 | |
| SCHEMBL9199436 | 0.93 | HTR2A (0.35) | HTR2AHRH1MAPTHTTNPSR1 | |
| SCHEMBL8526317 | 0.93 | HTR2A (0.35) | HTR2AHRH1MAPTHTTNPSR1 | |
| SCHEMBL9202601 | 0.93 | HTR2A (0.35) | HTR2AHRH1MAPTHTTNPSR1 | |
| SCHEMBL8586103 | 0.81 | HTR2A (0.35) | HTR2AHRH1MAPTHTTNPSR1 | |
| Trifluoroacetic Acid SCHEMBL9272122 | 0.79 | HTR2A (0.33) | HTR2AHRH1 | |
| Trifluoroacetic Acid SCHEMBL9269121 | 0.79 | HTR2A (0.33) | HTR2AHRH1 | |
| SCHEMBL8528250 | 0.76 | CA2 (0.35) | MAPTALDH1A1MEN1KMT2A | |
| SCHEMBL8120839 | 0.75 | SMN1; SMN2 (0.36) | MAPTHTTNPSR1KDM4EATM | |
| SCHEMBL8583795 | 0.74 | KDM4E (0.43) | MAPTKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0885186-A1 | AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND PROCESSES FOR PREPARING THEM | Dr. Karl Thomae GmbH (DE) | 1998-12-23 | — | — | EP | disclosed |
| WO-1997019911-A1 | AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND PROCESSES FOR PREPARING THEM | DR. KARL THOMAE GMBH (DE) | 1997-06-05 | — | — | WO | disclosed |