Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | USP2 | O75604 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.48 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | GPR68 | Q15743 | 2/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | KMO | O15229 | 1/20 | 0.42 |
| ▸ | ABL1 | P00519 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9566608 | 0.87 | NPC1 (0.58) | NPC1RAB9AMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL3945635 | 0.84 | ADORA1 (0.60) | USP2TSHRADORA1ADORA3MEN1 | |
| SCHEMBL9566586 | 0.81 | HTR2B (0.57) | NPC1RAB9AUSP2TSHRADORA1 | |
| SCHEMBL9564262 | 0.79 | ADORA1 (0.60) | NPC1RAB9AUSP2TSHRADORA1 | |
| SCHEMBL9566581 | 0.74 | RAB9A (1.00) | NPC1RAB9AADORA1ADORA3HRH4 | |
| SCHEMBL10483348 | 0.74 | SMN1; SMN2 (0.59) | NPC1RAB9AMEN1KMT2ALMNA | |
| SCHEMBL10083761 | 0.74 | ADORA1 (0.54) | USP2TSHRADORA1ADORA3MEN1 | |
| SCHEMBL8413034 | 0.73 | HDAC1 (0.56) | NPC1RAB9AUSP2TSHRADORA1 | |
| SCHEMBL9566457 | 0.73 | SMN1; SMN2 (0.55) | NPC1RAB9AUSP2TSHRMEN1 | |
| SCHEMBL9566631 | 0.73 | MEN1 (0.56) | NPC1RAB9AUSP2TSHRADORA1 |
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-0563386-A1 | ANTICANCER COMPOSITION AND COMPOUND | NIPPON SHINYAKU COMPANY, LIMITED (JP) | 1993-10-06 | — | — | EP | disclosed |