Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.41 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.41 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.41 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 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 | |
|---|---|---|---|---|
| SCHEMBL9303484 | 0.85 | NPC1 (0.49) | NPC1RAB9AKDM4ESMN1; SMN2MAPT | |
| SCHEMBL9303218 | 0.85 | PLAU (0.44) | NPC1RAB9AKDM4ESMN1; SMN2MAPT | |
| SCHEMBL9302810 | 0.83 | NPC1 (0.49) | NPC1RAB9AKDM4ESMN1; SMN2MAPT | |
| SCHEMBL9303532 | 0.82 | PLAU (0.57) | NPC1RAB9ACHRNB2CHRNB4CHRNA3 | |
| SCHEMBL9303518 | 0.81 | NPC1 (0.49) | NPC1RAB9AKDM4ESMN1; SMN2CHRNB2 | |
| SCHEMBL9303327 | 0.80 | RAB9A (0.44) | NPC1RAB9AKDM4ESMN1; SMN2MAPT | |
| SCHEMBL9303612 | 0.80 | NPC1 (0.43) | NPC1RAB9AKDM4ESMN1; SMN2MAPT | |
| SCHEMBL9302787 | 0.79 | PLAU (0.45) | NPC1RAB9APLAUMEN1KMT2A | |
| SCHEMBL9303967 | 0.79 | KCNJ11 (0.43) | NPC1RAB9AKDM4ESMN1; SMN2MAPT | |
| SCHEMBL9303439 | 0.78 | NPC1 (0.45) | NPC1RAB9AKDM4ESMN1; SMN2MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5352704-A | Antiviral agents | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1994-10-04 | — | — | US | disclosed |
| EP-0434432-B1 | Guanidinobenzene derivatives | BANYU PHARMA CO LTD (JP) | 1994-05-04 | — | — | EP | disclosed |
| EP-0434432-A1 | Guanidinobenzene derivatives | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1991-06-26 | — | — | EP | disclosed |