Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | DPP4 | P27487 | 2/20 | 0.32 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3261585 | 0.79 | CYP2C19 (0.36) | ALDH1A1LMNACYP3A4KDM4EMAPT | |
| SCHEMBL3258485 | 0.76 | KDM4E (0.40) | ALDH1A1LMNACYP3A4KDM4EMAPT | |
| SCHEMBL10452869 | 0.72 | CYP2C19 (0.36) | ALDH1A1LMNACYP3A4KDM4EMAPT | |
| SCHEMBL11766335 | 0.72 | CYP2D6 (0.37) | ALDH1A1LMNACYP3A4KDM4EMAPT | |
| SCHEMBL30104386 | 0.71 | CYP3A4 (0.33) | ALDH1A1CYP3A4KDM4EMAPTALOX15 | |
| SCHEMBL15295377 | 0.71 | CYP3A4 (0.33) | ALDH1A1CYP3A4KDM4EMAPTALOX15 | |
| SCHEMBL488830 | 0.71 | CYP2C19 (0.39) | ALDH1A1CYP3A4KDM4EMAPTALOX15 | |
| SCHEMBL1047388 | 0.71 | CYP2C19 (0.35) | ALDH1A1LMNACYP3A4KDM4EMAPT | |
| SCHEMBL6889278 | 0.71 | MIF (0.34) | ALDH1A1CYP3A4KDM4EMAPTALOX15 | |
| SCHEMBL30104387 | 0.71 | CYP3A4 (0.33) | ALDH1A1CYP3A4KDM4EMAPTALOX15 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6005112-A | REACTING SUBSTITUTED OR UNSUBSTITUTED PYRIDINE METAL COMPOUND WITH SUBSTITUTED ISOCYANATE OR ISOTHIOCYANATE | KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) | 1999-12-21 | — | — | US | disclosed |
| EP-0881217-A1 | PROCESS FOR PRODUCING PYRIDINECARBOXAMIDES OR THIOCARBOXAMIDES | KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) | 1998-12-02 | — | — | EP | disclosed |
| US-4195092-A | INSECTICIDES FOR TREATING MEXICAN BEAN BEETLE | ELI LILLY AND COMPANY (US) | 1980-03-25 | — | — | US | disclosed |