Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 5/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | USP2 | O75604 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | PPARD | Q03181 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL10446564 | 0.92 | KDM4E (0.49) | HTR2ARAB9ASMN1; SMN2NPC1GAA | |
| SCHEMBL10447005 | 0.87 | MEN1 (0.52) | HTR2ARAB9ASMN1; SMN2NPC1ALDH1A1 | |
| SCHEMBL10446676 | 0.83 | HTT (0.43) | RAB9ASMN1; SMN2NPC1POLBLMNA | |
| SCHEMBL10446599 | 0.83 | MEN1 (0.44) | RAB9ANPC1ALDH1A1LMNANPSR1 | |
| SCHEMBL10446783 | 0.83 | RAB9A (0.44) | RAB9ASMN1; SMN2NPC1ALDH1A1USP2 | |
| SCHEMBL10446779 | 0.82 | PKM (0.46) | RAB9ASMN1; SMN2NPC1POLBALDH1A1 | |
| SCHEMBL10446424 | 0.82 | RAB9A (0.46) | RAB9ANPC1GAAALDH1A1LMNA | |
| SCHEMBL10447008 | 0.82 | UBE2M (0.46) | LMNAPPARGPPARDPPARAHTT | |
| SCHEMBL10447101 | 0.82 | RAB9A (0.43) | RAB9ANPC1ALDH1A1USP2LMNA | |
| SCHEMBL10446781 | 0.81 | UBE2M (0.47) | RAB9ASMN1; SMN2NPC1GAATP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0399422-A1 | Benzocycloalkane derivatives and production thereof | Takeda Chemical Industries, Ltd. (JP) | 1990-11-28 | — | — | EP | disclosed |