Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 1/20 | 0.53 |
| ▸ | STS | P08842 | 8/20 | 0.43 |
| ▸ | ESR1 | P03372 | 5/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | G6PD | P11413 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | MPI | P34949 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 7/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10079009 | 0.79 | ESR1 (0.51) | SHBGSTSESR1ESR2KDM4E | |
| SCHEMBL7924361 | 0.79 | ESR1 (0.67) | SHBGSTSESR1ESR2KDM4E | |
| SCHEMBL6263461 | 0.79 | ESR1 (0.67) | SHBGSTSESR1ESR2KDM4E | |
| SCHEMBL7517563 | 0.79 | ESR1 (0.67) | SHBGSTSESR1ESR2KDM4E | |
| SCHEMBL7587734 | 0.79 | SHBG (0.64) | SHBGSTSESR1ESR2LMNA | |
| SCHEMBL9194502 | 0.79 | SHBG (0.60) | SHBGSTSESR1ESR2KDM4E | |
| SCHEMBL8378144 | 0.77 | SHBG (0.55) | SHBGSTSESR1CYP19A1 | |
| SCHEMBL7596151 | 0.77 | SHBG (0.58) | SHBGSTSESR1ESR2KDM4E | |
| SCHEMBL8509057 | 0.77 | STS (0.66) | SHBGSTSESR1ESR2KDM4E | |
| SCHEMBL15307736 | 0.76 | ESR1 (0.48) | SHBGSTSESR1ESR2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-2625190-B1 | DERIVATIVES OF STEROID BENZYLAMINES, HAVING AN ANTIPARASITIC, ANTIBACTERIAL, ANTIMYCOTIC AND/OR ANTIVIRAL ACTION | UNIV JUSTUS LIEBIG GIESSEN (DE) | 2021-07-14 | — | — | EP | disclosed |