Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.43 |
| ▸ | CTSS | P25774 | 1/20 | 0.43 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | AKT1 | P31749 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | AGER | Q15109 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1529700 | 0.85 | ATM (0.43) | HTR2CSLC6A4CTSLCTSBCTSS | |
| SCHEMBL8193756 | 0.83 | HTR2C (0.43) | HTR2CSLC6A4TSHRCTSLCTSB | |
| SCHEMBL7965436 | 0.83 | TSHR (0.43) | HTR2CSLC6A4TSHRCTSLCTSB | |
| SCHEMBL7190668 | 0.81 | RIPK1 (0.57) | HTR2CSLC6A4CTSLCTSBCTSS | |
| SCHEMBL7053417 | 0.81 | CA1 (0.50) | HTR2CSLC6A4CTSSRAB9ACA9 | |
| SCHEMBL24323788 | 0.81 | CA1 (0.50) | HTR2CSLC6A4CTSSRAB9ACA9 | |
| SCHEMBL20715723 | 0.80 | SLC6A4 (0.49) | HTR2CSLC6A4CTSLCTSBCTSS | |
| SCHEMBL24323548 | 0.80 | SYK (0.50) | DNM1CTSLCTSBCTSSAKT1 | |
| SCHEMBL1447140 | 0.80 | HDAC6 (0.36) | HTR2CSLC6A4CTSLCTSBCTSS | |
| SCHEMBL13215429 | 0.78 | SIGMAR1 (0.49) | MEN1KMT2ASMN1; SMN2 |
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-2022076625-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |