Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 7/20 | 0.52 |
| ▸ | HTR2B | P41595 | 1/20 | 0.52 |
| ▸ | HTR2A | P28223 | 10/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.52 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | CNR2 | P34972 | 2/20 | 0.47 |
| ▸ | CNR1 | P21554 | 2/20 | 0.45 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.45 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.45 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.45 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HTR6 | P50406 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4126980 | 0.83 | POLB (0.48) | ALDH1A1POLBMAPTSMN1; SMN2 | |
| SCHEMBL14932732 | 0.82 | ALDH1A1 (0.64) | HTR2CHTR2BHTR2AKCNH2HSD11B1 | |
| SCHEMBL19010409 | 0.78 | VCAM1 (0.47) | KMT2AALDH1A1POLBMAPTSMN1; SMN2 | |
| SCHEMBL20408989 | 0.77 | ALDH1A1 (0.47) | HTR2CHTR2BHTR2AKCNH2HSD11B1 | |
| SCHEMBL19010396 | 0.77 | TSHR (0.49) | KMT2AALDH1A1POLBMAPTSMN1; SMN2 | |
| SCHEMBL2474755 | 0.76 | HTR2A (0.59) | HTR2CHTR2BHTR2AKCNH2HSD11B1 | |
| SCHEMBL10451409 | 0.76 | ALDH1A1 (0.59) | KMT2AALDH1A1POLBMAPTSMN1; SMN2 | |
| SCHEMBL776706 | 0.75 | HTR6 (0.57) | HTR2CHTR2BHTR2AKCNH2HSD11B1 | |
| SCHEMBL7935381 | 0.75 | HTR2A (0.58) | HTR2CHTR2BHTR2AKCNH2HSD11B1 | |
| SCHEMBL250919 | 0.74 | AKR1B1 (0.53) | HTR2CHTR2BHTR2AHSD11B1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113061103-B | Preparation method of monofluoroolefin derivative | 中国科学院兰州化学物理研究所 | 2022-02-15 | — | — | CN | disclosed |
| CN-113061103-A | Preparation method of monofluoroolefin derivative | 中国科学院兰州化学物理研究所苏州研究院 | 2021-07-02 | — | — | CN | disclosed |