Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | FBP1 | P09467 | 6/20 | 0.55 |
| ▸ | VCP | P55072 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.50 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.49 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | TNF | P01375 | 1/20 | 0.47 |
| ▸ | HSPA1A | P0DMV8 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.47 |
| ▸ | ERN1 | O75460 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8926615 | 1.00 | HSD17B10 (0.58) | HSD17B10FBP1VCPCYP1A2CYP2D6 | |
| SCHEMBL27401905 | 0.82 | HSD17B10 (0.58) | HSD17B10CYP1A2CYP2D6AMY1AVCAM1 | |
| SCHEMBL16971225 | 0.81 | ALDH1A1 (0.56) | HSD17B10FBP1VCPMAPTHTT | |
| SCHEMBL16971227 | 0.81 | ALDH1A1 (0.56) | HSD17B10FBP1VCPMAPTHTT | |
| SCHEMBL18524352 | 0.81 | HSP90AA1 (0.47) | HSD17B10FBP1VCPCYP1A2CYP2D6 | |
| SCHEMBL9551018 | 0.81 | HSD17B10 (0.56) | HSD17B10CYP1A2CYP2D6AMY1AVCAM1 | |
| SCHEMBL9551019 | 0.81 | HSD17B10 (0.56) | HSD17B10CYP1A2CYP2D6AMY1AVCAM1 | |
| SCHEMBL18524351 | 0.81 | HSP90AA1 (0.47) | HSD17B10FBP1VCPCYP1A2CYP2D6 | |
| SCHEMBL307134 | 0.79 | ERN1 (0.65) | HSD17B10CYP1A2CYP2D6AMY1AVCAM1 | |
| SCHEMBL9775619 | 0.79 | HSD17B10 (0.55) | HSD17B10CYP1A2CYP2D6AMY1AVCAM1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5622916-A | PESTICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1997-04-22 | — | — | US | disclosed |
| US-5296503-A | Administering orally | BAYER AKTIENGESELLSCHAFT (DE) | 1994-03-22 | — | — | US | disclosed |
| US-5270340-A | Substituted 2-cyclohexen-1-yl-amine fungicidal and herbicidal agents | BAYER AKTIENGESELLSCHAFT (DE) | 1993-12-14 | — | — | US | disclosed |
| US-4148795-A | Dithiocarbamate ester bactericides and fungicides | AMERICAN CYANAMID COMPANY (US) | 1979-04-10 | — | — | US | disclosed |
| US-4038288-A | DITHIOCARBAMATE ESTER BACTERICIDES AND FUNGICIDES | AMERICAN CYANAMID COMPANY (US) | 1977-07-26 | — | — | US | disclosed |
| US-4011230-A | DITHIOCARBAMATE ESTER BACTERICIDES AND FUNGICIDES | AMERICAN CYANAMID COMPANY (US) | 1977-03-08 | — | — | US | disclosed |