Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 3/20 | 0.42 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.42 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.41 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8917265 | 1.00 | HTT (0.46) | HTTKMT2ASMN1; SMN2MAOBCYP1A1 | |
| SCHEMBL8915421 | 0.87 | THRB (0.50) | HTTKMT2ASMN1; SMN2MAOBCYP1A1 | |
| SCHEMBL8915413 | 0.87 | THRB (0.50) | HTTKMT2ASMN1; SMN2MAOBCYP1A1 | |
| SCHEMBL8962281 | 0.86 | HTT (0.46) | HTTKMT2ASMN1; SMN2MAOBCYP1A1 | |
| SCHEMBL8917835 | 0.86 | HTT (0.46) | HTTKMT2ASMN1; SMN2MAOBCYP1A1 | |
| Hydrochloric Acid SCHEMBL8422744 | 0.85 | HTT (0.45) | HTTKMT2ASMN1; SMN2MAOBCYP1A1 | |
| SCHEMBL8962277 | 0.82 | CA12 (0.55) | HTTKMT2ASMN1; SMN2MAOBCYP1A1 | |
| SCHEMBL8962278 | 0.82 | CA12 (0.55) | HTTKMT2ASMN1; SMN2MAOBCYP1A1 | |
| SCHEMBL7799631 | 0.81 | HTT (0.44) | HTTKMT2ASMN1; SMN2MAOBCYP1A1 | |
| SCHEMBL7799626 | 0.81 | HTT (0.44) | HTTKMT2ASMN1; SMN2MAOBCYP1A1 |
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-5663410-A | Cis-4-(2,2,3,3-tetrafluoropropoxy)-cinnamonitrile and trans-4-(2,2,3,3-tetrafluoropropoxy)-cinnamonitrile and a process for their preparation | HOECHST AKTIENGESELLSCHAFT | 1997-09-02 | — | — | US | disclosed |