Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.31 |
| ▸ | TXNRD3 | Q86VQ6 | 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 | |
|---|---|---|---|---|
| SCHEMBL10796434 | 0.77 | ALDH1A1 (0.52) | TSHRALDH1A1CYP3A4HSD17B10TDP1 | |
| SCHEMBL27410297 | 0.76 | ALDH1A1 (0.50) | TSHRALDH1A1CYP3A4HSD17B10TDP1 | |
| SCHEMBL10796310 | 0.74 | NMT1 (0.41) | TSHRALDH1A1CYP3A4HSD17B10MAPK1 | |
| SCHEMBL10799354 | 0.74 | ADRA2A (0.35) | TSHRALDH1A1CYP3A4HSD17B10MAPK1 | |
| SCHEMBL1625817 | 0.73 | TSHR (0.41) | TSHRALDH1A1HSD17B10MAPK1GPR35 | |
| SCHEMBL28006025 | 0.73 | HSP90AA1 (0.44) | ALDH1A1TDP1HPGDMAPK1 | |
| SCHEMBL11566698 | 0.73 | TSHR (0.46) | TSHRALDH1A1TDP1GRIN2DGRIN3B | |
| Nitric Acid SCHEMBL20984327 | 0.72 | TSHR (0.47) | TSHRALDH1A1CYP3A4HSD17B10TDP1 | |
| SCHEMBL10801328 | 0.70 | TSHR (0.44) | TSHRALDH1A1MAPK1 | |
| SCHEMBL11570409 | 0.70 | CYP1A2 (0.33) | TSHRALDH1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0003881-A1 | Substituted phenylnitramines, their preparation and their application as fungicidal agents | AMERICAN CYANAMID COMPANY (US) | 1979-09-05 | — | — | EP | claimed |
| US-4130645-A | Fungicidal phenylnitramines and new phenylnitramines | AMERICAN CYANAMID COMPANY (US) | 1978-12-19 | — | — | US | claimed |
| EP-0003881-A1 | Substituted phenylnitramines, their preparation and their application as fungicidal agents | AMERICAN CYANAMID COMPANY (US) | 1979-09-05 | — | — | EP | disclosed |
| US-4130645-A | Fungicidal phenylnitramines and new phenylnitramines | AMERICAN CYANAMID COMPANY (US) | 1978-12-19 | — | — | US | disclosed |
| US-4130645-A | Fungicidal phenylnitramines and new phenylnitramines | AMERICAN CYANAMID COMPANY (US) | 1978-12-19 | — | — | US | disclosed |