Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.41 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.41 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | SOS1 | Q07889 | 3/20 | 0.38 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2922854 | 0.79 | KDM4E (0.51) | KDM4ESMN1; SMN2LMNASLC6A4CHRM2 | |
| SCHEMBL2924537 | 0.79 | KDM4E (0.70) | KDM4ESMN1; SMN2LMNASLC6A4CHRM2 | |
| SCHEMBL2022959 | 0.79 | XIAP (0.40) | — | |
| SCHEMBL14013388 | 0.78 | SCN9A (0.36) | KDM4ESMN1; SMN2LMNAKCNH2 | |
| SCHEMBL4573863 | 0.78 | SCN9A (0.36) | KDM4ESMN1; SMN2LMNAKCNH2 | |
| Hydrochloric Acid SCHEMBL1238937 | 0.78 | KDM4E (0.68) | KDM4ESMN1; SMN2LMNASLC6A4CHRM2 | |
| Hydrochloric Acid SCHEMBL15568255 | 0.78 | KDM4E (0.68) | KDM4ESMN1; SMN2LMNASLC6A4CHRM2 | |
| SCHEMBL4574934 | 0.77 | KDM4E (0.34) | KDM4ESMN1; SMN2 | |
| SCHEMBL4574383 | 0.77 | RIPK1 (0.34) | KDM4ESMN1; SMN2 | |
| SCHEMBL14303254 | 0.77 | LMNA (0.46) | KDM4ESMN1; SMN2LMNASLC6A4CHRM2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008134035-A1 | ALPHA-UNSUBSTITUTED ARYLMETHYL PIPERAZINE PYRAZOLO[1,5-A] PYRIMIDINE AMIDE DERIVATIVES | PANACOS PHARMACEUTICALS, INC. (US) | 2008-11-06 | — | — | WO | disclosed |
| WO-2008134035-A1 | ALPHA-UNSUBSTITUTED ARYLMETHYL PIPERAZINE PYRAZOLO[1,5-A] PYRIMIDINE AMIDE DERIVATIVES | PANACOS PHARMACEUTICALS, INC. (US) | 2008-11-06 | — | — | WO | disclosed |