Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 2/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 3/20 | 0.38 |
| ▸ | NR1D1 | P20393 | 4/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.37 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8137127 | 0.99 | AKT1 (0.40) | AKT1CHRM2CHRM1CHRM3CHRM4 | |
| SCHEMBL8875240 | 0.96 | AKT1 (0.40) | AKT1CHRM2CHRM1CHRM3CHRM4 | |
| SCHEMBL8132756 | 0.89 | SYK (0.40) | CHRM2CHRM1CHRM3CHRM4CHRM5 | |
| SCHEMBL8134806 | 0.88 | SYK (0.40) | CHRM2CHRM1CHRM3CHRM4CHRM5 | |
| SCHEMBL5556101 | 0.84 | CCR6 (0.39) | CHRM2CHRM1CHRM3CHRM4CHRM5 | |
| SCHEMBL30915258 | 0.83 | AKT1 (0.50) | AKT1NR1D1NR1H3CTSLCTSB | |
| SCHEMBL8130601 | 0.82 | TDP1 (0.36) | CHRM2CHRM1CHRM3CHRM4CHRM5 | |
| SCHEMBL7203307 | 0.82 | CHRM2 (0.33) | CHRM2CHRM1CHRM3CHRM4CHRM5 | |
| SCHEMBL7562431 | 0.82 | AKT1 (0.49) | AKT1NR1D1NR1H3CTSLCTSB | |
| SCHEMBL8135274 | 0.81 | TDP1 (0.34) | CHRM2CHRM1CHRM3CHRM4CHRM5 |
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-6080785-A | REACTING A ALKYLNEDI-PRIMARY AMINE COMPOUND WITH A PROTECTIVE GROUP SUCH AS TRIFLUOROACETYL OR BENZYL GROUP REAGENT TO FORM AN INTERMEDIATE, REACTING THE INTERMEDIATE WITH HALOACETIC TERT-BYTYL ESTER TO FORM ESTER GROUPS, DEPROTECTING | SCHERING AKTIENGESELLSCHAFT (DE) | 2000-06-27 | — | — | US | disclosed |