Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 3/20 | 0.38 |
| ▸ | HTR2A | P28223 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 5/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23678513 | 0.78 | ALDH1A1 (0.43) | L3MBTL1RAB9ANPC1HTTTSHR | |
| SCHEMBL15500731 | 0.77 | ALDH1A1 (0.39) | SLC6A2MEN1KMT2AMAPTTSHR | |
| SCHEMBL19867286 | 0.77 | NPC1 (0.43) | RAB9ANPC1MAPTLMNACYP2C9 | |
| SCHEMBL20661304 | 0.77 | ESR1 (0.40) | SLC6A4ALDH1A1 | |
| SCHEMBL2737144 | 0.77 | SLC6A4 (0.45) | SLC6A4HTR2ASLC6A2HRH1HTR2B | |
| SCHEMBL13969489 | 0.74 | MAOA (0.41) | SLC6A4HTR2ASLC6A2SLC6A3MEN1 | |
| SCHEMBL13969483 | 0.74 | MEN1 (0.39) | MEN1KMT2AL3MBTL1RAB9ANPSR1 | |
| SCHEMBL13950430 | 0.73 | MAPT (0.41) | SLC6A4HTR2ASLC6A2HRH1HTR2B | |
| SCHEMBL10352481 | 0.72 | SLC6A4 (0.36) | SLC6A4HTR2ASLC6A2HRH1HTR2B | |
| SCHEMBL19114331 | 0.72 | ESR1 (0.37) | — |
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-9771321-B2 | Small molecules that covalently modify transthyretin | THE SCRIPPS RESEARCH INSTITUTE (US) | 2017-09-26 | — | — | US | disclosed |