Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 8/20 | 0.42 |
| ▸ | ADRA1D | P25100 | 7/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 7/20 | 0.42 |
| ▸ | ADRA1B | P35368 | 7/20 | 0.42 |
| ▸ | TRPV6 | Q9H1D0 | 3/20 | 0.42 |
| ▸ | HTR1D | P28221 | 1/20 | 0.41 |
| ▸ | HTR1B | P28222 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6714974 | 0.94 | ABCB1 (0.47) | ABCB1HTR1DHTR1BCHRM4CHRM1 | |
| SCHEMBL328237 | 0.92 | HTR1D (0.49) | DRD2ADRA1DADRA1AADRA1BHTR1D | |
| SCHEMBL7029357 | 0.85 | QDPR (0.52) | DRD2HTR1DHTR1BKDM4EALDH1A1 | |
| SCHEMBL7938441 | 0.84 | KDM4E (0.46) | ADRA1AKDM4EALDH1A1LMNAMAPT | |
| SCHEMBL7880812 | 0.82 | HTR2A (0.47) | HTR1DHTR1BEHMT2 | |
| SCHEMBL6717514 | 0.81 | EHMT2 (0.42) | DRD2HTR1DHTR1BKDM4EALDH1A1 | |
| SCHEMBL10036163 | 0.81 | HTR1D (0.49) | ABCB1DRD2ADRA1DADRA1AADRA1B | |
| SCHEMBL11819421 | 0.80 | HTR2A (0.53) | KDM4EALDH1A1LMNAMAPT | |
| SCHEMBL8536319 | 0.79 | SLC6A2 (0.44) | SIGMAR1KDM4EALDH1A1LMNAMAPT | |
| SCHEMBL12924603 | 0.79 | AXL (0.36) | DRD2KDM4EALDH1A1LMNAMAPT |
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-2004010943-A2 | SUBSTITUTED BENZANILIDES AS MODULATORS OF THE CCR5 RECEPTOR | SMITHKLINE BEECHAM CORPORATION (US) | 2004-02-05 | — | — | WO | disclosed |