Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | LTA4H | P09960 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 5/20 | 0.30 |
| ▸ | CNR1 | P21554 | 3/20 | 0.30 |
| ▸ | FABP4 | P15090 | 2/20 | 0.30 |
| ▸ | FABP5 | Q01469 | 2/20 | 0.30 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.30 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11648729 | 0.80 | HTT (0.33) | SMN1; SMN2HTT | |
| SCHEMBL11646598 | 0.80 | HTT (0.33) | SMN1; SMN2HTT | |
| SCHEMBL11513297 | 0.79 | GRIN2D (0.41) | SMN1; SMN2HTTCYP2C19CYP1A2USP2 | |
| SCHEMBL28524188 | 0.79 | CNR2 (0.39) | CYP2C19ALDH1A1CNR2 | |
| SCHEMBL7718359 | 0.77 | NAAA (0.40) | CNR2 | |
| SCHEMBL27753349 | 0.77 | CNR2 (0.40) | SMN1; SMN2HTTCYP2C19ALDH1A1LMNA | |
| SCHEMBL4616715 | 0.77 | CYP2C19 (0.39) | SMN1; SMN2HTTCYP2C19CYP1A2LTA4H | |
| SCHEMBL1663260 | 0.76 | CYP1A2 (0.32) | CYP2C19CYP1A2LTA4H | |
| SCHEMBL7713427 | 0.76 | NAAA (0.42) | — | |
| SCHEMBL10207201 | 0.75 | POLB (0.36) | CYP1A2LTA4HALDH1A1CNR2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101102774-A | Intravenous formulations of PDE-5 inhibitors | BAYER HEALTHCARE AG (DE) | 2008-01-09 | — | — | CN | disclosed |
| US-4171424-A | Polyesters containing units derived from metal salts of N-hydroxyalkylated branched α-aminoacids | CIBA-GEIGY CORPORATION (US) | 1979-10-16 | — | — | US | disclosed |
| US-4093639-A | HEAT RESISTANCE | CIBA-GEIGY CORPORATION (US) | 1978-06-06 | — | — | US | disclosed |