Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.39 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18756273 | 0.79 | CHRM2 (0.37) | MAPTCACNA1BAPBA1TSHRCYP3A4 | |
| SCHEMBL1161939 | 0.79 | TSHR (0.39) | MAPTCACNA1BAPBA1TSHRABCC4 | |
| Hydrochloric Acid SCHEMBL18725638 | 0.77 | CHRM2 (0.36) | MAPTCACNA1BAPBA1TSHRCYP3A4 | |
| SCHEMBL28273368 | 0.77 | TSHR (0.49) | MAPTCACNA1BAPBA1TSHRCYP3A4 | |
| SCHEMBL5134780 | 0.77 | MAPT (0.39) | MAPTCACNA1BAPBA1TSHRCYP3A4 | |
| SCHEMBL7398462 | 0.76 | ALOX15 (0.38) | TSHRALDH1A1SMN1; SMN2HSD17B10CYP2D6 | |
| SCHEMBL2070387 | 0.74 | MAPT (0.42) | MAPTCACNA1BAPBA1TSHRCYP3A4 | |
| SCHEMBL18756257 | 0.73 | TDP1 (0.36) | MAPTCACNA1BAPBA1TSHRCYP3A4 | |
| SCHEMBL2070390 | 0.73 | MAPT (0.39) | MAPTCACNA1BAPBA1TSHRCYP3A4 | |
| SCHEMBL7395821 | 0.73 | FFAR3 (0.38) | TSHRALDH1A1SMN1; SMN2HSD17B10MEN1 |
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-1255748-A1 | BETA-ALANINE DERIVATIVES AND THEIR USE AS RECEPTOR ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2002-11-13 | — | — | EP | disclosed |
| WO-2001060813-A1 | BETA-ALANINE DERIVATIVES AND THEIR USE AS RECEPTOR ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2001-08-23 | — | — | WO | disclosed |