Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | GRIN2D | O15399 | 10/20 | 0.36 |
| ▸ | GRIN3B | O60391 | 10/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 10/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 10/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 10/20 | 0.36 |
| ▸ | GRIN2C | Q14957 | 10/20 | 0.36 |
| ▸ | GRIN3A | Q8TCU5 | 10/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | CAPN9 | O14815 | 1/20 | 0.32 |
| ▸ | CASP3 | P42574 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | XBP1 | P17861 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL5274587 | 0.88 | TSHR (0.47) | ALDH1A1TSHRGRIN2DGRIN3BGRIN1 | |
| SCHEMBL8556823 | 0.86 | GRIN2D (0.35) | ALDH1A1TSHRGRIN2DGRIN3BGRIN1 | |
| SCHEMBL8558654 | 0.86 | TSHR (0.38) | ALDH1A1TSHRGRIN2DGRIN3BGRIN1 | |
| SCHEMBL8113141 | 0.83 | GRIN2D (0.45) | ALDH1A1TSHRGRIN2DGRIN3BGRIN1 | |
| SCHEMBL8114652 | 0.83 | TSHR (0.34) | ALDH1A1TSHRGRIN2DGRIN3BGRIN1 | |
| SCHEMBL8554603 | 0.82 | TSHR (0.34) | ALDH1A1TSHRGRIN2DGRIN3BGRIN1 | |
| SCHEMBL8122907 | 0.81 | TSHR (0.35) | ALDH1A1TSHRGRIN2DGRIN3BGRIN1 | |
| SCHEMBL7352737 | 0.80 | TSHR (0.34) | ALDH1A1TSHRGRIN2DGRIN3BGRIN1 | |
| SCHEMBL8121622 | 0.80 | GRIN2D (0.45) | ALDH1A1TSHRGRIN2DGRIN3BGRIN1 | |
| SCHEMBL8113964 | 0.80 | GRIN2D (0.38) | ALDH1A1TSHRGRIN2DGRIN3BGRIN1 |
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-0647137-A4 | GLYCINE RECEPTOR ANTAGONISTS AND THE USE THEREOF. | UNIV CALIFORNIA WEBER ECKARD (US) | 1998-09-16 | — | — | EP | disclosed |
| EP-0647137-A1 | GLYCINE RECEPTOR ANTAGONISTS AND THE USE THEREOF | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1995-04-12 | — | — | EP | disclosed |