Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 8/20 | 0.33 |
| ▸ | NPC1 | O15118 | 7/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.33 |
| ▸ | RELA | Q04206 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1518200 | 0.79 | RAB9A (0.47) | KMT2ARAB9ANPC1SMN1; SMN2HSD17B10 | |
| SCHEMBL1147718 | 0.76 | — | — | |
| SCHEMBL28043502 | 0.73 | MAPT (0.43) | KMT2ALMNARAB9ANPC1SMN1; SMN2 | |
| SCHEMBL27878947 | 0.73 | L3MBTL1 (0.37) | KMT2ALMNAMAP3K14RAB9ANPC1 | |
| SCHEMBL1396292 | 0.73 | MAPT (0.45) | KMT2ALMNARAB9ANPC1SMN1; SMN2 | |
| SCHEMBL6184106 | 0.73 | SCN3A (0.43) | KMT2AMEN1POLBKDM4EMAPT | |
| SCHEMBL4798282 | 0.72 | NOTUM (0.36) | KMT2ARAB9ANPC1SMN1; SMN2MAPT | |
| SCHEMBL9229231 | 0.72 | KMT2A (0.33) | KMT2ARAB9ANPC1CYP2C9ALDH1A1 | |
| SCHEMBL6184991 | 0.71 | CNR2 (0.52) | LMNAMAP3K14RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL11884446 | 0.70 | NPC1 (0.42) | KMT2ALMNAMAP3K14RAB9ANPC1 |
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-109232575-A | Pyrroles's [1,2-b] pyridazine compound or its officinal salt and their purposes | 中国科学院上海药物研究所 | 2019-01-18 | — | — | CN | disclosed |