Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 4/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 4/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 4/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.35 |
| ▸ | GRIN2C | Q14957 | 4/20 | 0.35 |
| ▸ | GRIN3A | Q8TCU5 | 4/20 | 0.35 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | XBP1 | P17861 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9776159 | 0.94 | TSHR (0.59) | TSHRALDH1A1TDP1CYP1A2CYP2D6 | |
| SCHEMBL3476651 | 0.94 | TSHR (0.65) | TSHRALDH1A1TDP1CYP1A2CYP2D6 | |
| SCHEMBL10710731 | 0.94 | TSHR (0.65) | TSHRALDH1A1TDP1CYP1A2CYP2D6 | |
| SCHEMBL4706746 | 0.90 | TSHR (0.55) | TSHRALDH1A1TDP1CYP1A2CYP2D6 | |
| Pentachloronitrobenzene SCHEMBL69247 | 0.90 | TSHR (0.62) | TSHRALDH1A1TDP1CYP1A2CYP2D6 | |
| SCHEMBL2357837 | 0.88 | TSHR (0.52) | TSHRALDH1A1TDP1CYP1A2CYP2D6 | |
| Pentachloronitrobenzene SCHEMBL18438924 | 0.88 | TSHR (0.59) | TSHRALDH1A1TDP1CYP1A2CYP2D6 | |
| SCHEMBL10985748 | 0.85 | TSHR (0.56) | TSHRALDH1A1TDP1CYP1A2CYP2D6 | |
| SCHEMBL1951434 | 0.80 | TSHR (0.52) | TSHRALDH1A1TDP1CYP1A2CYP2D6 | |
| SCHEMBL9219776 | 0.80 | TSHR (0.52) | TSHRALDH1A1CYP1A2CYP2D6CYP2C19 |
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-4324799-A | Fungicidal thioglycolic acid anilides, processes for their manufacture and pesticidal compositions containing them | HOECHST AKTIENGESELLSCHAFT (DE) | 1982-04-13 | — | — | US | disclosed |