Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 8/20 | 0.37 |
| ▸ | ACHE | P22303 | 8/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | TLR8 | Q9NR97 | 3/20 | 0.33 |
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.33 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.32 |
| ▸ | TACR1 | P25103 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 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 | |
|---|---|---|---|---|
| SCHEMBL7688997 | 0.89 | ESR1 (0.46) | BCHEACHEESR1ESR2TLR8 | |
| SCHEMBL7689050 | 0.86 | BCHE (0.40) | BCHEACHEESR1ESR2TLR8 | |
| SCHEMBL8789573 | 0.78 | BCHE (0.38) | BCHEACHEESR1ESR2TLR8 | |
| SCHEMBL9029036 | 0.78 | TLR9 (0.41) | TLR8TLR7TLR9TACR1 | |
| SCHEMBL8789634 | 0.78 | CCNB2 (0.47) | — | |
| SCHEMBL8789465 | 0.78 | CCNB2 (0.42) | — | |
| SCHEMBL8790583 | 0.72 | CCNB2 (0.41) | TLR8TLR7TLR9 | |
| SCHEMBL9027913 | 0.71 | CCNB2 (0.42) | TLR7TLR9TACR1 | |
| SCHEMBL7696222 | 0.71 | CCNB2 (0.42) | TLR7TLR9TACR1 | |
| SCHEMBL9029025 | 0.70 | FNTA (0.38) | TLR8TLR7TLR9TACR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002081444-A1 | 1-INDOLYL DERIVATIVES, USE THEREOF FOR PRODUCTION OF MEDICAMENTS, A METHOD FOR PRODUCTION OF SAID 1-INDOLYL DERIVATIVES AND PHARMACEUTICAL PREPARATIONS CONTAINING 1-INDOLYL DERIVATIVES | SCHERING AKTIENGESELLSCHAFT (DE) | 2002-10-17 | — | — | WO | disclosed |