Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTPS1 | P17812 | 3/20 | 0.47 |
| ▸ | AAK1 | Q2M2I8 | 7/20 | 0.47 |
| ▸ | GAK | O14976 | 2/20 | 0.46 |
| ▸ | STK16 | O75716 | 2/20 | 0.46 |
| ▸ | BMP2K | Q9NSY1 | 2/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.45 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | MAP2K7 | O14733 | 1/20 | 0.43 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.43 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.42 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL18953568 | 0.83 | HDAC4 (0.54) | CTPS1HDAC4MAP2K4 | |
| SCHEMBL12407118 | 0.79 | LMNA (0.52) | AAK1OPRM1LMNAGAAHPGD | |
| SCHEMBL28913080 | 0.78 | LMNA (0.54) | USP2LMNAGAAHPGDHTT | |
| SCHEMBL3088255 | 0.78 | HSD11B1 (0.57) | AAK1HDAC4OPRM1SMN1; SMN2HSD11B1 | |
| SCHEMBL6850398 | 0.77 | HDAC4 (0.56) | HDAC4OPRM1MAP2K7MAP2K4PTGS1 | |
| SCHEMBL11858223 | 0.77 | GPR35 (0.67) | GPR35GAASMN1; SMN2 | |
| SCHEMBL23540320 | 0.77 | CTPS1 (0.54) | CTPS1OPRM1LMNAHTTSMN1; SMN2 | |
| SCHEMBL19329644 | 0.77 | ALDH1A1 (0.65) | GPR35HPGDHTTSMN1; SMN2HSD17B1 | |
| SCHEMBL3088257 | 0.77 | HTR6 (0.56) | AAK1GAKSTK16BMP2KHDAC4 | |
| SCHEMBL22619047 | 0.76 | OPRM1 (0.48) | AAK1GAKSTK16BMP2KHDAC4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017098421-A1 | BENZOTHIADIAZINE COMPOUNDS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2017-06-15 | — | — | WO | disclosed |