Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 2/20 | 0.60 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.57 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.57 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.49 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL10128671 | 0.82 | LMNA (0.60) | ENPP3ENPP1RAB9ASMN1; SMN2IKBKE | |
| SCHEMBL8612081 | 0.82 | DGAT1 (0.56) | DGAT1ENPP3ENPP1RAB9ASMN1; SMN2 | |
| SCHEMBL8615555 | 0.82 | DGAT1 (0.56) | DGAT1ENPP3ENPP1RAB9ASMN1; SMN2 | |
| SCHEMBL9048918 | 0.80 | CYP1A2 (0.64) | DGAT1ENPP3ENPP1RAB9ASMN1; SMN2 | |
| SCHEMBL128703 | 0.80 | LMNA (0.67) | RAB9ASMN1; SMN2LMNACYP1A2PTGS1 | |
| SCHEMBL1765500 | 0.78 | DGAT1 (0.53) | DGAT1ENPP3ENPP1RAB9ASMN1; SMN2 | |
| SCHEMBL9084030 | 0.78 | DGAT1 (0.53) | DGAT1ENPP3ENPP1RAB9ASMN1; SMN2 | |
| SCHEMBL12359222 | 0.78 | CYP3A4 (0.61) | RAB9AMEN1NPC1KMT2AHDAC6 | |
| SCHEMBL404433 | 0.78 | CYP3A4 (0.66) | RAB9ASMN1; SMN2MEN1NPC1KMT2A | |
| SCHEMBL27743534 | 0.78 | CYP1A2 (0.61) | DGAT1ENPP3ENPP1RAB9ASMN1; SMN2 |
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-2011163355-A1 | FUSED HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASES (PDES) INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2011-12-29 | — | — | WO | disclosed |