Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 3/20 | 0.41 |
| ▸ | MAOA | P21397 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 5/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 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 | |
|---|---|---|---|---|
| SCHEMBL7015864 | 0.88 | TLR4 (0.48) | SMN1; SMN2TP53PKMNFKB1NFKB2 | |
| SCHEMBL28657269 | 0.83 | PIN1 (0.42) | MAOBMAOALMNAMAPTALDH1A1 | |
| SCHEMBL27493752 | 0.73 | CYP19A1 (0.39) | TP53LMNAMAPTNPC1RAB9A | |
| SCHEMBL11428678 | 0.72 | SMN1; SMN2 (0.37) | SMN1; SMN2LMNAPOLBMAPTALDH1A1 | |
| SCHEMBL4252795 | 0.70 | TDP1 (0.40) | SMN1; SMN2LMNAMAPTALDH1A1MEN1 | |
| SCHEMBL11241339 | 0.69 | CA12 (0.34) | LMNAMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL16953482 | 0.66 | MAPT (0.47) | SMN1; SMN2PTGS2MAOBLMNAPOLB | |
| SCHEMBL28550433 | 0.66 | MAOB (0.53) | SMN1; SMN2MAOBPOLBNPC1RAB9A | |
| SCHEMBL45896 | 0.66 | PTGS2 (0.80) | PTGS2MAOBLMNAPOLBMAPT | |
| SCHEMBL19223062 | 0.66 | LTA4H (0.67) | SMN1; SMN2TP53PKMNFKB1NFKB2 |
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-116332948-A | Nitrogen-containing tetracyclic compound, preparation method and medicinal application thereof | 翰森生物有限责任公司 | 2023-06-27 | — | — | CN | disclosed |