Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | EPHX1 | P07099 | 9/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 8/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4536597 | 0.88 | CYP19A1 (0.54) | CYP19A1KMT2AMEN1LMNAHTT | |
| SCHEMBL4537586 | 0.87 | EPHX1 (0.52) | LMNAHTTEPHX1EPHX2ALDH1A1 | |
| SCHEMBL4537010 | 0.84 | EPHX2 (0.55) | EPHX1EPHX2 | |
| SCHEMBL4541158 | 0.84 | ALDH1A1 (0.49) | CYP19A1KMT2AMEN1LMNAHTT | |
| SCHEMBL4538117 | 0.82 | FKBP1A (0.48) | KMT2AMEN1LMNASMN1; SMN2EPHX1 | |
| SCHEMBL4535739 | 0.82 | EPHX2 (0.54) | LMNAEPHX1EPHX2ALDH1A1NPSR1 | |
| SCHEMBL4542230 | 0.81 | CYP19A1 (0.54) | CYP19A1KMT2AMEN1LMNAHTT | |
| SCHEMBL4535087 | 0.81 | EPHX1 (0.49) | LMNAHTTEPHX1EPHX2NPSR1 | |
| SCHEMBL4539990 | 0.81 | USP2 (0.56) | KMT2AMEN1LMNAEPHX1EPHX2 | |
| SCHEMBL8062507 | 0.81 | EPHX2 (0.53) | EPHX1EPHX2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009070497-A1 | SEH AND 11 β-HSD1 INHIBITORS AND THEIR USE | SMITHKLINE BEECHAM CORPORATION (US) | 2009-06-04 | — | — | WO | claimed |
| WO-2009083526-A1 | NOVEL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-07-09 | — | — | WO | disclosed |
| WO-2009070497-A1 | SEH AND 11 β-HSD1 INHIBITORS AND THEIR USE | SMITHKLINE BEECHAM CORPORATION (US) | 2009-06-04 | — | — | WO | disclosed |