Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.37 |
| ▸ | LTB4R | Q15722 | 7/20 | 0.37 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.36 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.36 |
| ▸ | TNIK | Q9UKE5 | 4/20 | 0.35 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.34 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | LTB4R2 | Q9NPC1 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4092430 | 0.80 | NR1H4 (0.61) | NR1H4LTB4RSRD5A2MEN1LMNA | |
| SCHEMBL4102391 | 0.71 | NR1H4 (0.60) | NR1H4LTB4RSRD5A2MEN1LMNA | |
| SCHEMBL3333875 | 0.70 | NR1H4 (0.46) | NR1H4NPY5RTNIK | |
| SCHEMBL4089846 | 0.69 | MAPT (0.38) | MEN1LMNAMAPK1KMT2A | |
| SCHEMBL7379027 | 0.65 | CYP1A2 (0.50) | — | |
| SCHEMBL4085995 | 0.64 | SMN1; SMN2 (0.54) | SRD5A2MEN1LMNAKMT2A | |
| SCHEMBL4097796 | 0.63 | ALPL (0.64) | MEN1LMNAKMT2A | |
| SCHEMBL855024 | 0.62 | HCAR2 (0.48) | NR1H4 | |
| SCHEMBL10271521 | 0.62 | RAB9A (0.63) | NPY5RTNIKCSNK2A2CSNK2A1MEN1 | |
| SCHEMBL12298063 | 0.61 | RAB9A (0.55) | TNIKMEN1LMNAPKMKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2013176-A2 | DIARYL COMPOUNDS AS NON-STEROIDAL INHIBITORS OF 17-BETA HYDROXYSTEROID DEHYDROGENASE AND/OR STEROID SULPHATASE FOR THE TREATMENT OF OESTROGEN-RELATED DISEASES SUCH AS HORMONE DEPENDENT BREAST CANCER | Sterix Limited (GB) | 2009-01-14 | — | — | EP | disclosed |
| WO-2007096647-A2 | DIARYL COMPOUNDS AS NON-STEROIDAL INHIBITORS OF 17-BETA HYDROXYSTEROID DEHYDROGENASE AND/OR STEROID SULPHATASE FOR THE TREATMENT OF OESTROGEN-RELATED DISEASES SUCH AS HORMONE DEPENDENT BREAST CANCER | STERIX LIMITED (GB) | 2007-08-30 | — | — | WO | disclosed |