Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | GABRP | O00591 | 1/20 | 0.41 |
| ▸ | GABRD | O14764 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.41 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.41 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.41 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.41 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7443195 | 1.00 | ALDH1A1 (0.43) | ALDH1A1HTTSMN1; SMN2MMP13HPGD | |
| SCHEMBL7449281 | 0.86 | OPRM1 (0.44) | ALDH1A1MEN1KMT2AKDM4EGABRP | |
| SCHEMBL7449263 | 0.86 | OPRM1 (0.44) | ALDH1A1MEN1KMT2AKDM4EGABRP | |
| SCHEMBL7441218 | 0.82 | ALDH1A1 (0.45) | ALDH1A1HTTSMN1; SMN2MMP13HPGD | |
| SCHEMBL7433375 | 0.78 | RAB9A (0.40) | ALDH1A1HTTSMN1; SMN2HPGDLMNA | |
| SCHEMBL7443191 | 0.76 | CTSK (0.54) | ALDH1A1HTTSMN1; SMN2MMP13HPGD | |
| SCHEMBL7447641 | 0.75 | REN (0.40) | HTTSMN1; SMN2POLBKDM4E | |
| SCHEMBL7433115 | 0.74 | — | — | |
| SCHEMBL7446905 | 0.73 | TSHR (0.37) | ALDH1A1LMNAMEN1KMT2AKDM4E | |
| SCHEMBL7446912 | 0.73 | TSHR (0.37) | ALDH1A1LMNAMEN1KMT2AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-6187905-B1 | PEPTIDE COMPOUND WHICH INHIBITS VIRAL PROTEINASES; VIRICIDES FOR HEPATITIS C, HEPATITIS G, AND HUMAN GB VIRUSES | HOFFMANN-LA ROCHE INC. | 2001-02-13 | — | — | US | disclosed |