Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN11 | Q06124 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.46 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | GAK | O14976 | 1/20 | 0.43 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.42 |
| ▸ | AAK1 | Q2M2I8 | 5/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.41 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.40 |
| ▸ | KIT | P10721 | 1/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL13669265 | 0.88 | GAK (0.54) | PTPN11GAKAAK1NTRK1KIT | |
| SCHEMBL4336419 | 0.87 | AAK1 (0.44) | PTPN11NPC1RAB9ASMN1; SMN2PDGFRB | |
| SCHEMBL13668879 | 0.84 | KIT (0.50) | PTPN11GAKAAK1NTRK1KIT | |
| SCHEMBL13746240 | 0.84 | PTPN11 (0.53) | PTPN11PDGFRBPDGFRAPDPK1MAOB | |
| SCHEMBL13746306 | 0.82 | BRD4 (0.57) | PTPN11NPC1RAB9ASMN1; SMN2PDGFRB | |
| SCHEMBL13746286 | 0.81 | AAK1 (0.50) | PTPN11GAKAAK1NTRK1KIT | |
| SCHEMBL13746238 | 0.81 | PTPN11 (0.49) | PTPN11NPC1RAB9ASMN1; SMN2PDGFRB | |
| SCHEMBL15607500 | 0.78 | AAK1 (0.52) | MAPTGAKAAK1NTRK1KIT | |
| SCHEMBL4337406 | 0.78 | BRD4 (0.59) | MAPTGAKAAK1NTRK1KIT | |
| SCHEMBL1516618 | 0.78 | PTPN11 (0.48) | PTPN11NPC1SMN1; SMN2PDGFRBPDGFRA |
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 |
|---|---|---|---|---|---|---|---|
| US-7605168-B2 | Phosphodiesterase 4; asthma, chronic obstructive pulmonary disease, Alzheimer's disease, diffuse large-cell B cell lymphoma, and chronic lymphocytic leukemia; 8-[3-(3,4-dimethoxy-phenyl)-pyrrolo[2,3-b]pyridine-1-sulfonyl]-quinoline | PLEXXIKON, INC. (US) | 2009-10-20 | — | — | US | disclosed |