Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PHGDH | O43175 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
| ▸ | CCKAR | P32238 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6675909 | 0.92 | PHGDH (0.40) | PHGDHGAAKMT2AMAPTMAPK1 | |
| SCHEMBL6676074 | 0.91 | GAA (0.40) | PHGDHCYP2C9CYP2C19CYP1A2CYP3A4 | |
| SCHEMBL6673384 | 0.90 | GAA (0.39) | CYP2C9CYP2C19GAAKMT2AMAPT | |
| SCHEMBL6675492 | 0.90 | MAPT (0.45) | CYP2C9CYP2C19CYP1A2CYP3A4GAA | |
| SCHEMBL6673176 | 0.90 | GAA (0.39) | CYP2C9CYP2C19CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL6679148 | 0.88 | KMT2A (0.37) | PHGDHCYP2C9CYP2C19GAAKMT2A | |
| SCHEMBL6673426 | 0.88 | PHGDH (0.39) | PHGDHCYP2C9CYP2C19CYP1A2CYP3A4 | |
| SCHEMBL6673102 | 0.87 | KDM4E (0.46) | KMT2AMAPTL3MBTL1SMN1; SMN2MEN1 | |
| SCHEMBL6672608 | 0.87 | PHGDH (0.43) | PHGDHCYP2C9CYP2C19CYP1A2CYP3A4 | |
| SCHEMBL6678302 | 0.85 | PHGDH (0.40) | PHGDHGAAKMT2AMAPTMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1424072-A1 | N'-(pyridin-3-yl)-(4-phenylpiperazin-1-yl)-carboxyimidamide and -iminothiolate derivatives for the treatment of tumors | Samjin Pharmaceutical Co., Ltd. (KR) | 2004-06-02 | — | — | EP | disclosed |
| US-6683184-B2 | ANTITUMOR AGENTS | SAMJIN PHARMACEUTICAL CO., LTD. (KR) | 2004-01-27 | — | — | US | disclosed |