Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.47 |
| ▸ | POLB | P06746 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.46 |
| ▸ | LMNA | P02545 | 4/20 | 0.46 |
| ▸ | HTT | P42858 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | CTSS | P25774 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | MITF | O75030 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28630336 | 1.00 | L3MBTL1 (0.49) | L3MBTL1KMT2APOLBALDH1A1KDM4E | |
| SCHEMBL28300055 | 1.00 | L3MBTL1 (0.49) | L3MBTL1KMT2APOLBALDH1A1KDM4E | |
| SCHEMBL8321601 | 0.82 | L3MBTL1 (0.55) | L3MBTL1KMT2APOLBALDH1A1KDM4E | |
| SCHEMBL27319312 | 0.82 | L3MBTL1 (0.55) | L3MBTL1KMT2APOLBALDH1A1KDM4E | |
| SCHEMBL6655031 | 0.82 | L3MBTL1 (0.55) | L3MBTL1KMT2APOLBALDH1A1KDM4E | |
| SCHEMBL2315180 | 0.81 | L3MBTL1 (0.53) | L3MBTL1KMT2APOLBALDH1A1KDM4E | |
| SCHEMBL10702526 | 0.81 | ALDH1A1 (0.51) | L3MBTL1KMT2APOLBALDH1A1KDM4E | |
| SCHEMBL10702523 | 0.81 | ALDH1A1 (0.51) | L3MBTL1KMT2APOLBALDH1A1KDM4E | |
| SCHEMBL8326207 | 0.81 | L3MBTL1 (0.52) | L3MBTL1KMT2APOLBALDH1A1KDM4E | |
| SCHEMBL9556348 | 0.81 | L3MBTL1 (0.52) | L3MBTL1KMT2APOLBALDH1A1KDM4E |
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-109280044-B | Raltitrexed impurity C and preparation and application thereof | 南京正大天晴制药有限公司 | 2021-04-02 | — | — | CN | disclosed |
| CN-107616976-B | A kind of pharmaceutical composition of Raltitrexed and preparation method thereof | 南京正大天晴制药有限公司 | 2019-06-21 | — | — | CN | disclosed |