Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100A4 | P26447 | 1/20 | 0.43 |
| ▸ | LCK | P06239 | 1/20 | 0.42 |
| ▸ | PTPRC | P08575 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 3/20 | 0.40 |
| ▸ | MAOB | P27338 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.39 |
| ▸ | TUBB | P07437 | 1/20 | 0.39 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.39 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.39 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.39 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.39 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.39 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.39 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.39 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17199713 | 0.90 | LCK (0.50) | S100A4LCKPTPRCNPSR1PLK4 | |
| SCHEMBL1242518 | 0.88 | PTPRC (0.47) | S100A4LCKPTPRCALDH1A1CYP1A2 | |
| SCHEMBL17199708 | 0.85 | S100A4 (0.48) | S100A4LCKPTPRCMAOAMAOB | |
| SCHEMBL9177130 | 0.85 | CYP19A1 (0.48) | S100A4LCKPTPRCTUBB4ATUBB | |
| SCHEMBL9177137 | 0.85 | CYP19A1 (0.48) | S100A4LCKPTPRCTUBB4ATUBB | |
| SCHEMBL28640571 | 0.80 | ALDH1A1 (0.50) | ALDH1A1HSD11B1MAOAMAOBNPSR1 | |
| SCHEMBL19420890 | 0.80 | APP (0.45) | S100A4LCKPTPRCTUBB4ATUBB | |
| SCHEMBL17199700 | 0.78 | PTPRC (0.48) | S100A4LCKPTPRCCYP1A2MAPK1 | |
| SCHEMBL17199705 | 0.76 | LCK (0.40) | S100A4LCKPTPRCALDH1A1MAOA | |
| SCHEMBL14506934 | 0.74 | AMY1A (0.42) | S100A4LCKPTPRCALDH1A1MAOA |
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-2015161989-A1 | HOLE-TRANSPORT MATERIALS FOR ORGANIC SOLAR CELLS OR ORGANIC OPTICAL SENSORS | BASF SE (DE) | 2015-10-29 | — | — | WO | disclosed |
| EP-2937399-A1 | Hole-transport materials for organic solar cells or organic optical sensors | BASF SE (DE) | 2015-10-28 | — | — | EP | disclosed |