Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.49 |
| ▸ | CNR2 | P34972 | 1/20 | 0.49 |
| ▸ | GRIA1 | P42261 | 2/20 | 0.49 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.49 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.49 |
| ▸ | TACR1 | P25103 | 3/20 | 0.48 |
| ▸ | CDK2 | P24941 | 1/20 | 0.46 |
| ▸ | ACACB | O00763 | 1/20 | 0.44 |
| ▸ | CHRND | Q07001 | 4/20 | 0.44 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.44 |
| ▸ | CHRNG | P07510 | 1/20 | 0.44 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3046555 | 1.00 | CNR1 (0.49) | CNR1CNR2GRIA1ITGB3ITGA2B | |
| SCHEMBL3055439 | 1.00 | CNR1 (0.49) | CNR1CNR2GRIA1ITGB3ITGA2B | |
| SCHEMBL3055440 | 1.00 | CNR1 (0.49) | CNR1CNR2GRIA1ITGB3ITGA2B | |
| SCHEMBL3055186 | 0.99 | CNR1 (0.50) | CNR1CNR2GRIA1ITGB3ITGA2B | |
| SCHEMBL3055185 | 0.99 | CNR1 (0.50) | CNR1CNR2GRIA1ITGB3ITGA2B | |
| SCHEMBL3055258 | 0.95 | TACR1 (0.50) | CNR1CNR2GRIA1ITGB3ITGA2B | |
| SCHEMBL3055256 | 0.95 | TACR1 (0.50) | CNR1CNR2GRIA1ITGB3ITGA2B | |
| SCHEMBL3046854 | 0.89 | TACR1 (0.52) | CNR1CNR2GRIA1ITGB3ITGA2B | |
| SCHEMBL3046853 | 0.89 | TACR1 (0.52) | CNR1CNR2GRIA1ITGB3ITGA2B | |
| SCHEMBL11676193 | 0.88 | TACR1 (0.58) | CNR2ITGB3ITGA2BTACR1KMT2A |
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-RE41339-E1 | N-acetyl aldosamines, N-acetylamino acids and related N-acetyl compounds and their topical use | TRISTRATA, INC. (US) | 2010-05-18 | — | — | US | claimed |
| CN-102167766-A | Vinyl amino acid (ester) polymer and preparation method thereof | UNIV BEIJING CHEMICAL | 2011-08-31 | — | — | CN | disclosed |