Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLS | O94925 | 2/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | DRD3 | P35462 | 2/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | EDNRB | P24530 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | MC4R | P32245 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | MC3R | P41968 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21644503 | 0.90 | GLS (0.48) | GLSHDAC7SMN1; SMN2CYP1A2CYP2D6 | |
| SCHEMBL4561865 | 0.84 | LMNA (0.57) | HDAC7SMN1; SMN2EPHX1SLC6A3LMNA | |
| SCHEMBL10698580 | 0.84 | LMNA (0.48) | SMN1; SMN2KMT2AKDM4ESLC6A3LMNA | |
| SCHEMBL8938105 | 0.83 | SMN1; SMN2 (0.43) | HDAC7SMN1; SMN2CYP1A2CYP2D6PKM | |
| SCHEMBL9716936 | 0.83 | NPC1 (0.49) | SMN1; SMN2KMT2AKDM4ESLC6A3LMNA | |
| SCHEMBL20538944 | 0.81 | LMNA (0.43) | SMN1; SMN2CYP1A2CYP2D6PKMNPSR1 | |
| SCHEMBL6624926 | 0.80 | GLS (0.50) | GLSSMN1; SMN2CYP1A2CYP2D6PKM | |
| SCHEMBL4561509 | 0.80 | EPHX1 (0.49) | SMN1; SMN2CYP1A2CYP2D6PKMNPSR1 | |
| SCHEMBL30728008 | 0.78 | LMNA (0.58) | SMN1; SMN2CYP1A2CYP2D6NPSR1KDM4E | |
| SCHEMBL17536560 | 0.77 | SMN1; SMN2 (0.44) | SMN1; SMN2CYP1A2CYP2D6PKMNPSR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2002074763-A9 | BENZIMIDAZOL DERIVATIVES MODULATE CHEMOKINE RECEPTORS | ASTRAZENECA AB (SE) | 2002-10-24 | — | — | WO | claimed |
| EP-1263724-A1 | NOVEL COMPOUNDS | AstraZeneca AB (SE) | 2002-12-11 | — | — | EP | disclosed |
| WO-2001062728-A1 | NOVEL COMPOUNDS | ASTRAZENECA AB (SE) | 2001-08-30 | — | — | WO | disclosed |