Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.61 |
| ▸ | NPC1 | O15118 | 2/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 2/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | GBA1 | P04062 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.49 |
| ▸ | TUBB | P07437 | 1/20 | 0.49 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.49 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.49 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL28515025 | 0.89 | TSHR (0.50) | KMT2ANPC1KDM4ECA1CA2 | |
| SCHEMBL29653680 | 0.86 | KMT2A (0.47) | KMT2ANPC1KDM4ECA1CA2 | |
| SCHEMBL28518633 | 0.84 | KMT2A (0.69) | KMT2ANPC1KDM4ECA1CA2 | |
| SCHEMBL29399711 | 0.84 | NPC1 (0.66) | KMT2ANPC1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL2553094 | 0.84 | NPC1 (0.66) | KMT2ANPC1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL154613 | 0.84 | NPC1 (0.66) | KMT2ANPC1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL11196552 | 0.83 | KDM4E (0.58) | KMT2AKDM4ECA1CA2ALDH1A1 | |
| SCHEMBL17304613 | 0.83 | KMT2A (0.77) | KMT2ANPC1CA1CA2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL5679748 | 0.82 | NPC1 (0.64) | KMT2ANPC1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL10889144 | 0.82 | NPC1 (0.64) | KMT2ANPC1KDM4EALDH1A1SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112375168-B | Side chain rod-shaped polar liquid crystal polymer, preparation method thereof and application thereof in nonlinear optical field | 华南理工大学 | 2022-03-29 | — | — | CN | disclosed |
| CN-112375168-A | Side chain rod-shaped polar liquid crystal polymer, preparation method thereof and application thereof in nonlinear optical field | 华南理工大学 | 2021-02-19 | — | — | CN | disclosed |
| CN-112342032-A | Rod-like polar liquid crystal molecule, preparation method thereof and rod-like polar nematic liquid crystal | 华南理工大学 | 2021-02-09 | — | — | CN | disclosed |