Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.37 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KIF11 | P52732 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | TERT | O14746 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19953499 | 0.79 | FABP5 (0.39) | ALDH1A1AADATKMT2AMEN1MAPT | |
| SCHEMBL19953762 | 0.76 | ALDH1A1 (0.46) | ALDH1A1KMT2ATSHRGAAMEN1 | |
| SCHEMBL19953634 | 0.75 | AADAT (0.37) | ALDH1A1AADATKMT2AMEN1MAPT | |
| SCHEMBL9465746 | 0.72 | ALDH1A1 (0.44) | ALDH1A1AADATKIF11 | |
| SCHEMBL28829408 | 0.71 | ALDH1A1 (0.44) | ALDH1A1AADATGAAKIF11TERT | |
| SCHEMBL2029995 | 0.66 | TSHR (0.61) | KMT2ATSHRGAAMAPT | |
| SCHEMBL892450 | 0.66 | PTPN1 (0.43) | AADATKMT2AKIF11 | |
| SCHEMBL19953619 | 0.66 | HRH4 (0.34) | ALDH1A1TSHRGAAMAPK1HSD17B10 | |
| SCHEMBL5001522 | 0.65 | BMPR1B (0.43) | AADATKMT2AMEN1 | |
| SCHEMBL8551856 | 0.64 | SRD5A1 (0.45) | AADATKMT2AMEN1BRD4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018047983-A1 | INDANE DERIVATIVES USEFUL AS MODULATORS OF MGLUR7 | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-03-15 | — | — | WO | disclosed |
| WO-2018047983-A1 | INDANE DERIVATIVES USEFUL AS MODULATORS OF MGLUR7 | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-03-15 | — | — | WO | disclosed |