Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHR1 | P34998 | 6/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.35 |
| ▸ | MAT2A | P31153 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HTR3A | P46098 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18464844 | 0.75 | POLB (0.42) | S1PR4MAT2APDE10APOLBHTR3A | |
| SCHEMBL18464843 | 0.72 | SCN9A (0.52) | S1PR4MAT2APDE10APOLBHTR3A | |
| SCHEMBL9317145 | 0.66 | MAPT (0.38) | TP53KDM4ELMNAHTT | |
| SCHEMBL2757279 | 0.63 | CYP2A6 (0.53) | S1PR4POLB | |
| SCHEMBL10918137 | 0.63 | POLB (0.47) | TP53PDE10APOLB | |
| SCHEMBL3973470 | 0.62 | POLB (0.44) | MAT2APOLBKDM4ELMNAHTT | |
| SCHEMBL10272812 | 0.62 | POLB (0.40) | CRHR1S1PR4MAT2APOLBKDM4E | |
| Hydrochloric Acid SCHEMBL8375181 | 0.61 | HTT (0.54) | TP53KDM4ELMNAHTTHSD17B10 | |
| SCHEMBL26534113 | 0.61 | NPY5R (0.47) | CRHR1PDE10AHTR3AKDM4EHTT | |
| Iodide SCHEMBL28915696 | 0.61 | CYP2A6 (0.52) | S1PR4POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0946520-B1 | ISOQUINOLINAMINE AND PHTHALAZINAMINE DERIVATIVES WHICH INTERACT WITH CRF RECEPTORS | NEUROGEN CORP (US) | 2003-04-02 | — | — | EP | disclosed |