Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | VCAM1 | P19320 | 8/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL9300062 | 0.79 | TSHR (0.42) | TDP1HSD17B10KMT2AMEN1ACHE | |
| SCHEMBL1197086 | 0.79 | TDP1 (0.42) | TDP1HSD17B10TSHRMAPK1VCAM1 | |
| SCHEMBL6047875 | 0.78 | TDP1 (0.41) | TDP1HSD17B10TSHRMAPK1VCAM1 | |
| SCHEMBL27605510 | 0.76 | TSHR (0.39) | TDP1HSD17B10KMT2AMEN1ACHE | |
| SCHEMBL7828557 | 0.71 | ALDH1A1 (0.46) | TDP1HSD17B10KMT2AMEN1TSHR | |
| SCHEMBL28008163 | 0.69 | GPR35 (0.43) | TDP1HSD17B10TSHRMAPK1VCAM1 | |
| SCHEMBL27619045 | 0.68 | TSHR (0.39) | TDP1HSD17B10KMT2AMEN1ACHE | |
| SCHEMBL28113405 | 0.68 | TSHR (0.42) | TDP1TSHRMAPK1VCAM1ALDH1A1 | |
| SCHEMBL27807540 | 0.68 | TSHR (0.39) | TDP1HSD17B10KMT2AMEN1ACHE | |
| SCHEMBL3317507 | 0.67 | ALDH1A1 (0.41) | TDP1HSD17B10KMT2AMEN1ACHE |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1994012163-A1 | 2-NITROARYL AND 2-CYANOARYL COMPOUNDS AS REGULATORS OF NITRIC OXIDE SYNTHASE | ABBOTT LABORATORIES (US) | 1994-06-09 | — | — | WO | claimed |
| US-5362747-A | Promoters, inhibitors | ABBOTT LABORATORIES (US) | 1994-11-08 | — | — | US | disclosed |
| WO-1994012163-A1 | 2-NITROARYL AND 2-CYANOARYL COMPOUNDS AS REGULATORS OF NITRIC OXIDE SYNTHASE | ABBOTT LABORATORIES (US) | 1994-06-09 | — | — | WO | disclosed |