Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 1/20 | 0.55 |
| ▸ | PARP1 | P09874 | 1/20 | 0.52 |
| ▸ | DHODH | Q02127 | 1/20 | 0.49 |
| ▸ | PLAU | P00749 | 3/20 | 0.49 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.47 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | PARP15 | Q460N3 | 2/20 | 0.46 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.46 |
| ▸ | PIM1 | P11309 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | DGAT1 | O75907 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL613558 | 0.93 | LCK (0.62) | LCKPARP1DHODHPLAUKDM4E | |
| SCHEMBL203205 | 0.91 | DHODH (0.55) | DHODHSRD5A1SRD5A2KDM4EPIM1 | |
| SCHEMBL30020656 | 0.91 | DHODH (0.55) | DHODHSRD5A1SRD5A2KDM4EPIM1 | |
| Hydrochloric Acid SCHEMBL1001004 | 0.89 | DHODH (0.54) | DHODHSRD5A1SRD5A2KDM4EPIM1 | |
| SCHEMBL29771387 | 0.89 | LCK (0.67) | LCKPARP1DHODHPLAUKDM4E | |
| SCHEMBL1163640 | 0.89 | LCK (0.67) | LCKPARP1DHODHPLAUKDM4E | |
| SCHEMBL15774265 | 0.87 | LCK (0.60) | LCKPARP1DHODHPLAUKDM4E | |
| SCHEMBL2049058 | 0.85 | SRD5A1 (0.53) | DHODHSRD5A1SRD5A2KDM4EPIM1 | |
| Methoxymethane SCHEMBL27807143 | 0.84 | KDM4E (0.62) | DHODHPLAUSRD5A1SRD5A2KDM4E | |
| SCHEMBL10081752 | 0.81 | PTPN1 (0.53) | DHODHSRD5A1SRD5A2KDM4EPIM1 |
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-2011061168-A1 | ARYL-PYRIDINE DERIVATIVES AS ALDOSTERONE SYNTHASE INHIBITORS | NOVARTIS AG (CH) | 2011-05-26 | — | — | WO | disclosed |