Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 7/20 | 0.51 |
| ▸ | CYP11B2 | P19099 | 7/20 | 0.51 |
| ▸ | HTT | P42858 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | TNF | P01375 | 1/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | IDO1 | P14902 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | CSF1R | P07333 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16879732 | 0.85 | HTT (0.46) | CYP11B1CYP11B2HTTLMNASMN1; SMN2 | |
| SCHEMBL16879639 | 0.85 | CSF1R (0.59) | CYP11B1CYP11B2HTTLMNASMN1; SMN2 | |
| SCHEMBL16879615 | 0.84 | CYP19A1 (0.42) | CYP19A1 | |
| SCHEMBL16879951 | 0.84 | MEN1 (0.46) | CYP19A1GRM2CSF1RMEN1KMT2A | |
| SCHEMBL9200139 | 0.82 | CYP11B1 (0.64) | CYP11B1CYP11B2HTTLMNASMN1; SMN2 | |
| SCHEMBL16879474 | 0.81 | CYP19A1 (0.63) | CYP11B1CYP11B2HTTLMNASMN1; SMN2 | |
| SCHEMBL16879728 | 0.81 | HTT (0.46) | CYP11B1CYP11B2HTTLMNASMN1; SMN2 | |
| SCHEMBL16879930 | 0.80 | CYP11B1 (0.62) | CYP11B1CYP11B2HTTLMNASMN1; SMN2 | |
| SCHEMBL16879770 | 0.80 | HTT (0.56) | CYP11B1CYP11B2HTTLMNASMN1; SMN2 | |
| SCHEMBL16879621 | 0.79 | HTT (0.47) | CYP11B1CYP11B2HTTLMNASMN1; SMN2 |
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-3089966-A1 | NEW SUBSTITUTED BIPHENYL ANALOGUES AS DUAL INHIBITORS OF AROMATASE AND SULFATASE | Beaufour Ipsen Tianjin Pharmaceutical Co., Ltd (CN) | 2016-11-09 | — | — | EP | disclosed |
| WO-2015100609-A1 | NEW SUBSTITUTED BIPHENYL ANALOGUES AS DUAL INHIBITORS OF AROMATASE AND SULFATASE | BEAUFOUR IPSEN TIANJIN PHARMACEUTICAL CO., LTD (CN) | 2015-07-09 | — | — | WO | disclosed |