Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 3/20 | 0.50 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.49 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | PTGES | O14684 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.42 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.41 |
| ▸ | CSNK1G2 | P78368 | 1/20 | 0.41 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.39 |
| ▸ | CTSB | P07858 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL24883385 | 1.00 | HTR6 (0.50) | HTR6GPR119DRD2DRD3PTGES | |
| SCHEMBL2709110 | 0.89 | PTGES (0.52) | HTR6GPR119DRD2DRD3PTGES | |
| SCHEMBL3104207 | 0.80 | SOS1 (0.61) | HTR6GPR119PTGESHRH4CYP1A2 | |
| SCHEMBL8513477 | 0.80 | HTR6 (0.52) | HTR6GPR119SOS1 | |
| SCHEMBL31349365 | 0.80 | HTR6 (0.52) | HTR6GPR119 | |
| SCHEMBL195554 | 0.76 | HTR6 (0.53) | HTR6CYP1A2CYP3A4LMNA | |
| SCHEMBL3088134 | 0.76 | SOS1 (0.56) | HTR6GPR119PTGESHRH4LMNA | |
| SCHEMBL24331245 | 0.75 | FAAH (0.52) | PTGESDPP4 | |
| Hydrochloric Acid SCHEMBL4058879 | 0.75 | HTR6 (0.52) | HTR6CYP1A2CYP3A4LMNA | |
| SCHEMBL31349431 | 0.75 | ALDH1A1 (0.58) | HTR6GPR119CYP1A2CYP3A4LMNA |
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-2023283608-A1 | COMPOUNDS FOR MODULATING MYCOBACTERIUM TUBERCULOSIS RESPONSE | TRUSTEES OF TUFTS COLLEGE (US) | 2023-01-12 | — | — | WO | disclosed |