Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29520290 | 0.91 | IDO1 (0.38) | MAPTACHEIDO1 | |
| SCHEMBL29520777 | 0.90 | IDO1 (0.39) | MAPTACHEIDO1 | |
| SCHEMBL29520721 | 0.74 | MEN1 (0.33) | RAB9AKDM4ENPC1ALDH1A1MAPT | |
| SCHEMBL12912867 | 0.67 | IDO1 (0.50) | RAB9AKDM4ENPC1ALDH1A1MAPT | |
| SCHEMBL29520737 | 0.65 | IDO1 (0.40) | KDM4EALDH1A1MAPTSMN1; SMN2MEN1 | |
| SCHEMBL14455177 | 0.65 | IDO1 (0.41) | RAB9AKDM4ENPC1ALDH1A1MAPT | |
| SCHEMBL29520487 | 0.64 | IDO1 (0.41) | KDM4EALDH1A1MAPTSMN1; SMN2MEN1 | |
| SCHEMBL12912969 | 0.64 | NPC1 (0.46) | RAB9AKDM4ENPC1ALDH1A1MAPT | |
| SCHEMBL29520739 | 0.63 | CNR1 (0.34) | RAB9AKDM4ENPC1ALDH1A1IDO1 | |
| SCHEMBL29520695 | 0.62 | MAPT (0.43) | KDM4EALDH1A1MAPTSMN1; SMN2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112174901-B | Synthesis method and anticancer activity of 1, 3-benzodiazepine compound | 河南师范大学 | 2022-02-08 | — | — | CN | disclosed |