Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL21401922 | 0.83 | HTT (0.59) | HTTALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL18914368 | 0.83 | HTT (0.49) | HTTALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL17693443 | 0.82 | HTT (0.54) | HTTALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL18914738 | 0.82 | HTT (0.58) | HTTALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL18104617 | 0.80 | HTT (0.56) | HTTALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL20245185 | 0.79 | ALDH1A1 (0.52) | HTTALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL18914742 | 0.78 | HTT (0.46) | HTTALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL28426282 | 0.78 | TSHR (0.53) | HTTALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL69791 | 0.77 | HTT (0.69) | HTTALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL28427399 | 0.76 | HDAC4 (0.65) | HTTALDH1A1HPGDMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017091435-A1 | OLIGOMERIZATIONS OF FDCA AND GLYCOLS IN A ONE-POT ESTERIFICATION-TRANSESTERIFICATION PROCESS CATALYZED BY HOMOGENEOUS ORGANOMETALLIC LEWIS ACIDS | ARCHER DANIELS MIDLAND COMPANY (US) | 2017-06-01 | — | — | WO | disclosed |