Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 6/20 | 0.35 |
| ▸ | CA1 | P00915 | 4/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.31 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29624642 | 0.83 | CA2 (0.54) | CA2CA1MAPK1CHRM2CHRM4 | |
| SCHEMBL5654010 | 0.75 | — | — | |
| SCHEMBL21443793 | 0.74 | PAOX (0.34) | PAOXCHRM2CHRM4CHRM1CHRM3 | |
| SCHEMBL11051419 | 0.74 | LMNA (0.35) | PAOXCHRM2CHRM4CHRM1CHRM3 | |
| SCHEMBL12983162 | 0.74 | PLA2G1B (0.35) | TSHRMAPK1PAOXCHRM2CHRM4 | |
| SCHEMBL5377086 | 0.74 | — | — | |
| SCHEMBL13636208 | 0.74 | — | — | |
| SCHEMBL541995 | 0.72 | — | — | |
| SCHEMBL15033639 | 0.72 | CHRM1 (0.43) | CA2MAPK1CHRM1CHRM3LMNA | |
| Acetic Acid SCHEMBL28023001 | 0.72 | LMNA (0.34) | PAOXCHRM2CHRM4CHRM1CHRM3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004041781-A1 | PREPARATION OF 3-AMINOALKYL-SUBSTITUTED INDOLE DERIVATIVES FROM PHENYLHYDRAZINES AND AMINOKETONES | SUVEN LIFE SCIENCES LIMITED (IN) | 2004-05-21 | — | — | WO | claimed |
| WO-2004041781-A1 | PREPARATION OF 3-AMINOALKYL-SUBSTITUTED INDOLE DERIVATIVES FROM PHENYLHYDRAZINES AND AMINOKETONES | SUVEN LIFE SCIENCES LIMITED (IN) | 2004-05-21 | — | — | WO | disclosed |