Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | S100A4 | P26447 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9319797 | 0.88 | TDP1 (0.54) | ALDH1A1TSHRTDP1GPR35HPGD | |
| SCHEMBL1696805 | 0.82 | ALDH1A1 (0.64) | ALDH1A1TSHRTDP1HPGDSMN1; SMN2 | |
| SCHEMBL29126640 | 0.79 | ALDH1A1 (0.52) | ALDH1A1TSHRTDP1GPR35HPGD | |
| SCHEMBL10902775 | 0.79 | TDP1 (0.64) | ALDH1A1TSHRTDP1GPR35HPGD | |
| SCHEMBL5248139 | 0.74 | TDP1 (0.58) | ALDH1A1TSHRTDP1GPR35HPGD | |
| SCHEMBL7779774 | 0.74 | TDP1 (0.52) | ALDH1A1TSHRTDP1GPR35HPGD | |
| SCHEMBL10722276 | 0.74 | ALDH1A1 (0.46) | ALDH1A1TSHRHPGDHSD17B10NPC1 | |
| SCHEMBL18224179 | 0.73 | ALDH1A1 (0.69) | ALDH1A1TSHRTDP1GPR35HPGD | |
| SCHEMBL8329812 | 0.73 | ALDH1A1 (0.48) | ALDH1A1TSHRTDP1GPR35HPGD | |
| SCHEMBL5622028 | 0.73 | ALDH1A1 (0.53) | ALDH1A1TSHRTDP1GPR35HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-5705698-A | Process for the production of pendimethalin and iso-pendimethalin | SRM CHEMICAL, LTD. CO. (US) | 1998-01-06 | — | — | US | disclosed |
| US-4609759-A | Process for preparing amino-2, 4-dinitroaromatic herbicides | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1986-09-02 | — | — | US | disclosed |