Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | TNNI3K | Q59H18 | 2/20 | 0.33 |
| ▸ | RORC | P51449 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 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 | |
|---|---|---|---|---|
| SCHEMBL22453074 | 0.79 | PARP1 (0.41) | HTR2AKCNH2LMNAHTTHPGD | |
| SCHEMBL22453159 | 0.78 | PDE7A (0.43) | SLC6A4HTR2ALMNASMN1; SMN2HPGD | |
| SCHEMBL22453069 | 0.75 | RAB9A (0.47) | LMNAHTTSMN1; SMN2MEN1GAA | |
| SCHEMBL22453760 | 0.75 | RAB9A (0.40) | HTTSMN1; SMN2MEN1GAAPKM | |
| SCHEMBL22453356 | 0.74 | HTR2C (0.32) | SLC6A4HTR2AKCNH2EPHX2MEN1 | |
| SCHEMBL22453360 | 0.73 | HTR2A (0.33) | SLC6A4HTR2AKCNH2EPHX2MEN1 | |
| SCHEMBL22452710 | 0.71 | MEN1 (0.44) | LMNAMEN1KMT2AALDH1A1 | |
| SCHEMBL22453463 | 0.71 | CRHBP (0.39) | KCNH2SMN1; SMN2EPHX2MEN1KMT2A | |
| SCHEMBL22452630 | 0.70 | LMNA (0.45) | LMNAEPHX2PKMKMT2AALDH1A1 | |
| SCHEMBL2707940 | 0.66 | RXRA (0.48) | LMNAMEN1KMT2AALDH1A1 |
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-2020190774-A1 | NOVEL SMALL MOLECULE INHIBITORS OF TEAD TRANSCRIPTION FACTORS | THE GENERAL HOSPITAL CORPORATION (US) | 2020-09-24 | — | — | WO | disclosed |