Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 5/20 | 0.59 |
| ▸ | NPC1 | O15118 | 4/20 | 0.59 |
| ▸ | CASP3 | P42574 | 2/20 | 0.59 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.59 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.59 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.59 |
| ▸ | ATM | Q13315 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.53 |
| ▸ | MAPT | P10636 | 6/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.52 |
| ▸ | RELA | Q04206 | 1/20 | 0.52 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29678523 | 1.00 | RAB9A (0.59) | RAB9ANPC1CASP3SENP8SENP7 | |
| SCHEMBL1773457 | 0.86 | RAB9A (0.70) | RAB9ANPC1CASP3SENP8SENP7 | |
| SCHEMBL25866687 | 0.86 | SMN1; SMN2 (0.65) | RAB9ANPC1CASP3SENP8SENP7 | |
| SCHEMBL4386607 | 0.83 | RAB9A (0.74) | RAB9ANPC1CASP3SENP8SENP7 | |
| SCHEMBL9647875 | 0.83 | SMN1; SMN2 (0.74) | RAB9ANPC1CASP3SENP8SENP7 | |
| SCHEMBL4434197 | 0.83 | MDM2 (0.67) | RAB9ANPC1CASP3SENP8SENP7 | |
| SCHEMBL31339958 | 0.82 | RAB9A (0.60) | RAB9ANPC1CASP3SENP8SENP7 | |
| SCHEMBL28330529 | 0.81 | SMN1; SMN2 (0.71) | RAB9ANPC1CASP3SENP8SENP7 | |
| SCHEMBL22355099 | 0.79 | ALDH1A1 (0.56) | RAB9ANPC1ATMSMN1; SMN2MAPT | |
| Lithium Ion SCHEMBL30052304 | 0.79 | SMN1; SMN2 (0.51) | RAB9ANPC1CASP3SENP8SENP7 |
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-115215923-A | Macrocyclic broad spectrum antibiotics | 豪夫迈·罗氏有限公司 | 2022-10-21 | — | — | CN | disclosed |
| CN-114007605-A | Macrocyclic broad spectrum antibiotics | 豪夫迈·罗氏有限公司 | 2022-02-01 | — | — | CN | disclosed |