Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 5/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | CTSV | O60911 | 1/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CRHBP | P24387 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7009210 | 0.88 | NPC1 (0.50) | KMT2ANPC1RAB9ALMNAMEN1 | |
| SCHEMBL28359300 | 0.82 | NPC1 (0.47) | KMT2ANPC1RAB9ALMNAMEN1 | |
| SCHEMBL28366989 | 0.81 | KMT2A (0.49) | KMT2ANPC1RAB9ALMNAMEN1 | |
| SCHEMBL9524084 | 0.81 | LMNA (0.71) | KMT2ALMNAMEN1MAPTALDH1A1 | |
| SCHEMBL5224480 | 0.81 | ALDH1A1 (0.65) | KMT2ALMNAMEN1MAPTL3MBTL1 | |
| SCHEMBL8346676 | 0.81 | RAB9A (0.50) | KMT2ANPC1RAB9ALMNAMEN1 | |
| SCHEMBL20680892 | 0.80 | PKM (0.45) | KMT2ANPC1RAB9ALMNAMEN1 | |
| SCHEMBL1895525 | 0.79 | PDGFRA (0.53) | — | |
| SCHEMBL29463677 | 0.78 | LMNA (0.65) | KMT2ANPC1RAB9ALMNAMEN1 | |
| SCHEMBL17653813 | 0.78 | MGLL (0.54) | KMT2ANPC1RAB9ALMNAMEN1 |
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-106883216-B | Preparation method of oxitinib | 张家港威胜生物医药有限公司 | 2020-03-13 | — | — | CN | disclosed |
| CN-105601620-A | Method for preparing mereletinib mesylate | BEIJING KANG LISHENG PHARMACEUTICAL TECH DEV CO LTD | 2016-05-25 | — | — | CN | disclosed |