Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 5/20 | 0.53 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.53 |
| ▸ | MGLL | Q99685 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | TPH1 | P17752 | 1/20 | 0.47 |
| ▸ | TPH2 | Q8IWU9 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.46 |
| ▸ | TACR3 | P29371 | 1/20 | 0.46 |
| ▸ | TNKS | O95271 | 1/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.46 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7370469 | 0.81 | TP53 (0.59) | GRIN2BGRIN1MGLLTP53HSD17B10 | |
| SCHEMBL7368689 | 0.77 | F2 (0.60) | GRIN2BGRIN1TP53HSD17B10LMNA | |
| SCHEMBL4069591 | 0.74 | PIN1 (0.63) | GRIN2BGRIN1 | |
| SCHEMBL7367336 | 0.74 | F2 (0.61) | MGLLLMNA | |
| SCHEMBL7360128 | 0.72 | F2 (0.69) | MGLLLMNA | |
| SCHEMBL23335875 | 0.72 | GRIN2B (0.74) | GRIN2BGRIN1HTR2B | |
| SCHEMBL7359608 | 0.72 | F2 (0.68) | MGLLHSD17B10TSHR | |
| SCHEMBL23682656 | 0.71 | TACR3 (0.83) | MGLLTP53HSD17B10LMNATACR3 | |
| SCHEMBL2711765 | 0.71 | USP2 (0.54) | GRIN2B | |
| SCHEMBL7400815 | 0.71 | TACR3 (0.57) | MGLLTP53HSD17B10TACR3 |
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-0960102-A1 | AMIDINOINDOLES, AMIDINOAZOLES, AND ANALOGS THEREOF AS INHIBITORS OF FACTOR Xa AND OF THROMBIN | Du Pont Pharmaceuticals Company (US) | 1999-12-01 | — | — | EP | disclosed |
| WO-1998001428-A1 | AMIDINOINDOLES, AMIDINOAZOLES, AND ANALOGS THEREOF AS INHIBITORS OF FACTOR Xa AND OF THROMBIN | DU PONT PHARMACEUTICALS COMPANY (US) | 1998-01-15 | — | — | WO | disclosed |