Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | STAT1 | P42224 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | RPA1 | P27694 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | HTR7 | P34969 | 1/20 | 0.45 |
| ▸ | ABL1 | P00519 | 1/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.44 |
| ▸ | BCR | P11274 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | CACNB4 | O00305 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28299729 | 0.86 | NPC1 (0.46) | RAB9AMAPTNPC1MAPK1MEN1 | |
| SCHEMBL28300981 | 0.85 | CCKAR (0.45) | RAB9ARPA1CACNB4CACNA1ACACNA1G | |
| SCHEMBL28299665 | 0.84 | NPC1 (0.55) | RAB9AMAPTNPC1SMN1; SMN2ABL1 | |
| SCHEMBL28301021 | 0.84 | CA1 (0.55) | RAB9ARPA1PTGS2 | |
| SCHEMBL28847575 | 0.83 | CSF1R (0.43) | RAB9AMAPTNPC1MAPK1MEN1 | |
| SCHEMBL28301083 | 0.83 | CA1 (0.46) | RAB9AMAPTNPC1MAPK1MEN1 | |
| SCHEMBL11377231 | 0.82 | NPC1 (0.73) | RAB9AMAPTNPC1MAPK1RPA1 | |
| SCHEMBL28301090 | 0.82 | TUBB4A (0.49) | RAB9AMAPTNPC1CACNB4CACNA1A | |
| SCHEMBL28953735 | 0.81 | CKS1B (0.41) | RAB9AMAPTNPC1MAPK1MEN1 | |
| SCHEMBL28847492 | 0.81 | HTR1A (0.40) | RAB9AMAPTNPC1MAPK1MEN1 |
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-109890822-A | INHIBITORS OF CELLULAR METABOLIC PROCESSES | 安吉奥斯医药品有限公司 | 2019-06-14 | — | — | CN | disclosed |