Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 7/20 | 0.43 |
| ▸ | NPC1 | O15118 | 6/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11226995 | 0.81 | ALDH1A1 (0.47) | ALDH1A1TSHRPOLBRAB9ANPC1 | |
| SCHEMBL2774804 | 0.81 | NPC1 (0.48) | ALDH1A1TSHRPOLBRAB9ANPC1 | |
| SCHEMBL31705064 | 0.79 | QDPR (0.42) | ALDH1A1POLBHSD17B10TP53 | |
| SCHEMBL31705865 | 0.77 | HPGD (0.40) | ALDH1A1TSHRRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL2643948 | 0.74 | CYP1A2 (0.43) | ALDH1A1POLBRAB9ANPC1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL5510469 | 0.73 | CYP1A2 (0.42) | ALDH1A1POLBRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL8553020 | 0.72 | THRB (0.46) | POLBSMN1; SMN2MEN1KMT2ANPSR1 | |
| SCHEMBL10859670 | 0.71 | POLB (0.44) | ALDH1A1TSHRPOLBRAB9ANPC1 | |
| SCHEMBL7020662 | 0.71 | DAO (0.35) | ALDH1A1TSHRHPGDHSD17B10 | |
| SCHEMBL11525875 | 0.70 | CSNK2A2 (0.56) | ALDH1A1RAB9ANPC1SMN1; SMN2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5591695-A | Herbicidal [1,3,4]oxadiazoles and thiadiazoles | AMERICAN CYANAMID CO. (US) | 1997-01-07 | — | — | US | disclosed |
| CN-1134935-A | Herbicidal (1,3,4) oxadiazoles and thiadiazoles | AMERICAN CYANAMID CO (US) | 1996-11-06 | — | — | CN | disclosed |
| EP-0726263-A2 | Herbicidal (1,3,4)oxadiazoles and thiadiazoles | American Cyanamid Company (US) | 1996-08-14 | — | — | EP | disclosed |