Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.44 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | ADCY8 | P40145 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9319040 | 0.89 | CYP3A4 (0.46) | CCR5CYP3A4CYP2C9ERCC1ERCC4 | |
| SCHEMBL9319873 | 0.87 | CYP3A4 (0.45) | CCR5CYP3A4CYP2C9ERCC1ERCC4 | |
| SCHEMBL9318635 | 0.87 | ALDH1A1 (0.39) | LMNASMN1; SMN2SIGMAR1KMT2AGAA | |
| SCHEMBL9319368 | 0.84 | MEN1 (0.47) | CCR5CYP3A4CYP2C9ERCC1ERCC4 | |
| SCHEMBL9320919 | 0.84 | OPRM1 (0.50) | CCR5CYP3A4CYP2C9ERCC1ERCC4 | |
| SCHEMBL9319058 | 0.84 | CCR5 (0.45) | CCR5CYP3A4CYP2C9ERCC1ERCC4 | |
| SCHEMBL9319108 | 0.83 | OPRD1 (0.50) | CYP3A4CYP2C9SMN1; SMN2ALDH1A1 | |
| SCHEMBL9320946 | 0.82 | GRM5 (0.38) | LMNASMN1; SMN2KMT2AGAAALDH1A1 | |
| SCHEMBL9319482 | 0.81 | CYP3A4 (0.47) | CCR5CYP3A4CYP2C9ERCC1ERCC4 | |
| SCHEMBL9318734 | 0.77 | PRSS1 (0.51) | CCR5CYP3A4CYP2C9ERCC1ERCC4 |
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-5350861-A | Insecticides, acaricides, fungicides, antimycotic agents | BAYER AKTIENGESELLSCHAFT (DE) | 1994-09-27 | — | — | US | disclosed |