Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11230077 | 0.86 | NPC1 (0.36) | SMN1; SMN2NPC1LMNARAB9ATP53 | |
| SCHEMBL11246825 | 0.82 | SMN1; SMN2 (0.33) | SMN1; SMN2NPC1LMNARAB9ATP53 | |
| SCHEMBL11227159 | 0.82 | SMN1; SMN2 (0.50) | SMN1; SMN2NPC1LMNARAB9APOLB | |
| SCHEMBL11456066 | 0.79 | SMN1; SMN2 (0.35) | SMN1; SMN2NPC1LMNARAB9ATP53 | |
| SCHEMBL11233277 | 0.79 | ALDH1A1 (0.39) | SMN1; SMN2NPC1LMNARAB9ATP53 | |
| SCHEMBL11222210 | 0.78 | RAB9A (0.52) | SMN1; SMN2NPC1LMNARAB9ATP53 | |
| SCHEMBL11220429 | 0.74 | ADORA3 (0.62) | SMN1; SMN2NPC1LMNARAB9ATP53 | |
| SCHEMBL11241140 | 0.73 | TYK2 (0.47) | NPC1RAB9APOLBALDH1A1HPGD | |
| SCHEMBL11447780 | 0.73 | NPC1 (0.31) | SMN1; SMN2NPC1LMNARAB9ATP53 | |
| SCHEMBL11236660 | 0.72 | ADORA3 (0.60) | SMN1; SMN2NPC1RAB9ATP53ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4337081-A | 5-Amido-3-trihalomethyl-1,2,4-thiadiazoles and their use as herbicides | OLIN CORPORATION (US) | 1982-06-29 | — | — | US | disclosed |