Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR3 | P29371 | 2/20 | 0.83 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.72 |
| ▸ | MEN1 | O00255 | 1/20 | 0.72 |
| ▸ | POLB | P06746 | 1/20 | 0.72 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.72 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.66 |
| ▸ | TSHR | P16473 | 1/20 | 0.65 |
| ▸ | LMNA | P02545 | 5/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.65 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.65 |
| ▸ | HTT | P42858 | 2/20 | 0.64 |
| ▸ | NPC1 | O15118 | 1/20 | 0.64 |
| ▸ | TP53 | P04637 | 1/20 | 0.64 |
| ▸ | RAB9A | P51151 | 1/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | HPGD | P15428 | 1/20 | 0.61 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.60 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL6450086 | 0.91 | TACR3 (1.00) | TACR3KDM4EMEN1POLBKMT2A | |
| SCHEMBL28806105 | 0.89 | TACR3 (0.76) | TACR3KDM4EMEN1POLBKMT2A | |
| SCHEMBL29271531 | 0.86 | TACR3 (0.71) | TACR3KDM4EMEN1POLBKMT2A | |
| SCHEMBL6447321 | 0.82 | TACR3 (0.81) | TACR3KDM4EMEN1POLBKMT2A | |
| SCHEMBL28511608 | 0.81 | MAPT (0.82) | TACR3KDM4EMEN1POLBKMT2A | |
| SCHEMBL6630664 | 0.81 | TACR3 (0.72) | TACR3KDM4EMEN1POLBKMT2A | |
| SCHEMBL10391576 | 0.81 | TACR3 (0.76) | TACR3KDM4EMEN1POLBKMT2A | |
| SCHEMBL6447770 | 0.81 | TACR3 (0.75) | TACR3KDM4EMEN1POLBKMT2A | |
| SCHEMBL8689228 | 0.80 | DHODH (0.82) | KDM4EPOLBKMT2AALDH1A1LMNA | |
| SCHEMBL28806099 | 0.80 | TACR3 (0.62) | TACR3KDM4EMEN1POLBKMT2A |
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-114890947-B | Aromatic heterocyclic compound containing quinoline structural unit, and preparation method and application thereof | 郑州大学 | 2024-07-16 | — | — | CN | disclosed |
| CN-114890947-A | Aromatic heterocyclic compound containing quinoline structural unit and preparation method and application thereof | 郑州大学 | 2022-08-12 | — | — | CN | disclosed |