Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | TYR | P14679 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.43 |
| ▸ | CES1 | P23141 | 1/20 | 0.43 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL11238948 | 0.83 | LMNA (0.56) | TSHRALDH1A1HSD17B10HDAC1NR1H4 | |
| SCHEMBL13170119 | 0.82 | CES2 (0.65) | CES2CES1SRD5A2FFAR1AKR1C3 | |
| SCHEMBL2847913 | 0.80 | ALDH1A1 (0.79) | TSHRALDH1A1HSD17B10HDAC1NR1H4 | |
| SCHEMBL12267916 | 0.79 | NR1H4 (0.57) | TSHRALDH1A1HSD17B10HDAC1NR1H4 | |
| SCHEMBL1432166 | 0.78 | NR1H4 (0.42) | TSHRALDH1A1HSD17B10HDAC1NR1H4 | |
| SCHEMBL28795485 | 0.77 | ALDH1A1 (0.49) | TSHRALDH1A1HSD17B10HDAC1NR1H4 | |
| SCHEMBL280235 | 0.76 | ALDH1A1 (0.48) | TSHRALDH1A1HSD17B10NR1H4LMNA | |
| SCHEMBL6758776 | 0.76 | ALDH1A1 (0.68) | TSHRALDH1A1HSD17B10NR1H4LMNA | |
| SCHEMBL17377318 | 0.76 | ESR1 (0.52) | TSHRALDH1A1NR1H4LMNACYP1A2 | |
| SCHEMBL14464110 | 0.76 | KEAP1 (0.44) | ALDH1A1LMNACES2CES1SMN1; SMN2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5405860-A | Fungicides | BAYER AKTIENGESELLSCHAFT (DE) | 1995-04-11 | — | — | US | disclosed |
| US-4912122-A | Triazolyl alkanones or triazolyl-alkanols | BAYER AKTIENGESELLSCHAFT (DE) | 1990-03-27 | — | — | US | disclosed |
| US-4776877-A | FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1988-10-11 | — | — | US | disclosed |
| US-4772623-A | FUNGICIDES, MICROBIOCIDES, PLANT GROWTH REGULATORS | BAYER AKTIENGESELLSCHAFT (DE) | 1988-09-20 | — | — | US | disclosed |
| US-4582843-A | FUNGICIDES, MICROBIOCIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1986-04-15 | — | — | US | disclosed |