Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.43 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.42 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL10397808 | 1.00 | NPC1 (0.46) | NPC1RAB9ASMN1; SMN2KDM4ETSHR | |
| SCHEMBL10396464 | 1.00 | NPC1 (0.46) | NPC1RAB9ASMN1; SMN2KDM4ETSHR | |
| SCHEMBL10399182 | 0.82 | LMNA (0.41) | KDM4ETSHRLMNAMAPTMDM2 | |
| SCHEMBL10399181 | 0.82 | LMNA (0.41) | KDM4ETSHRLMNAMAPTMDM2 | |
| SCHEMBL24187394 | 0.81 | MAPT (0.50) | NPC1RAB9ASMN1; SMN2KDM4ETSHR | |
| SCHEMBL30395674 | 0.81 | MAPT (0.50) | NPC1RAB9ASMN1; SMN2KDM4ETSHR | |
| SCHEMBL10397897 | 0.79 | MAPT (0.55) | NPC1RAB9AKDM4ECASP3SENP7 | |
| SCHEMBL5692921 | 0.79 | MAPT (0.55) | NPC1RAB9AKDM4ECASP3SENP7 | |
| SCHEMBL5692918 | 0.79 | MAPT (0.55) | NPC1RAB9AKDM4ECASP3SENP7 | |
| SCHEMBL10398857 | 0.77 | CES2 (0.48) | NPC1RAB9ATSHRMAPTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4975438-A | ANTICOAGULANT | HOFFMANN-LA ROCHE INC. (US) | 1990-12-04 | — | — | US | disclosed |
| US-4788206-A | CARDIOVASCULAR DISORDERS, PLATELETS | HOFFMANN-LA ROCHE INC. (US) | 1988-11-29 | — | — | US | disclosed |