Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 5/20 | 0.40 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.40 |
| ▸ | ERBB3 | P21860 | 2/20 | 0.40 |
| ▸ | KDR | P35968 | 2/20 | 0.40 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CTRC | Q99895 | 1/20 | 0.34 |
| ▸ | CACNA1D | Q01668 | 2/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL16864140 | 0.85 | ALDH1A1 (0.40) | TDP1ALDH1A1HPGDSMN1; SMN2CACNA1D | |
| SCHEMBL18960789 | 0.75 | HPGD (0.38) | TDP1ALDH1A1HPGDTSHRSMN1; SMN2 | |
| SCHEMBL17033547 | 0.72 | MEN1 (0.36) | TDP1ALDH1A1HPGDTSHRSMN1; SMN2 | |
| SCHEMBL19622891 | 0.71 | — | — | |
| SCHEMBL17179058 | 0.70 | — | — | |
| SCHEMBL20080324 | 0.68 | HPGDS (0.35) | — | |
| SCHEMBL19071685 | 0.67 | KDM1A (0.34) | CYP3A4 | |
| SCHEMBL27462291 | 0.66 | ADORA2A (0.36) | EGFRERBB2ERBB3KDRPTK2 | |
| SCHEMBL18436106 | 0.66 | CYP19A1 (0.36) | ALDH1A1HPGDSMN1; SMN2HSD17B10CTRC | |
| SCHEMBL22838126 | 0.66 | CYP19A1 (0.36) | ALDH1A1HPGDSMN1; SMN2HSD17B10CTRC |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016002864-A1 | TRIAZINE COMPOUND, METHOD FOR PRODUCING SAME, AND APPLICATION FOR SAME | 東ソー株式会社 | 2016-01-07 | — | — | WO | disclosed |