Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | MIF | P14174 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | SCN4A | P35499 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7922065 | 0.84 | NOTUM (0.41) | PLCG1NOTUMTSHRMIF | |
| SCHEMBL7922009 | 0.83 | MEN1 (0.38) | MEN1KMT2AL3MBTL1TSHRPOLB | |
| Hydrochloric Acid SCHEMBL7931055 | 0.82 | MEN1 (0.37) | MEN1KMT2AL3MBTL1LMNAMAPK1 | |
| Hydrochloric Acid SCHEMBL7922067 | 0.70 | MAPK1 (0.34) | MEN1KMT2ANOTUML3MBTL1BLM | |
| SCHEMBL7526631 | 0.69 | MEN1 (0.43) | MEN1KMT2AL3MBTL1TSHRPOLB | |
| SCHEMBL29541321 | 0.67 | MAOA (0.49) | MEN1KMT2ANOTUML3MBTL1TSHR | |
| SCHEMBL2860722 | 0.67 | MAOA (0.49) | MEN1KMT2ANOTUML3MBTL1TSHR | |
| SCHEMBL16577250 | 0.67 | PLCG1 (0.36) | PLCG1 | |
| SCHEMBL6796058 | 0.67 | CA12 (0.43) | MEN1KMT2AL3MBTL1TSHRPOLB | |
| SCHEMBL950483 | 0.66 | KDM1A (0.43) | NOTUML3MBTL1TSHRPOLBCYP3A4 |
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-1140896-A1 | BENZOTHIEPIN-ANILIDE DERIVATIVES, THEIR PRODUCTION AND THEIR USE FOR ANTAGONIZING CCR-5 | Takeda Chemical Industries, Ltd. (JP) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000037455-A1 | BENZOTHIEPIN-ANILIDE DERIVATIVES, THEIR PRODUCTION AND THEIR USE FOR ANTAGONIZING CCR-5 | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2000-06-29 | — | — | WO | disclosed |