Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | SLC9A1 | P19634 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.41 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | RAD52 | P43351 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | GRM5 | P41594 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13377948 | 0.87 | HPGD (0.39) | TSHRCYP1A2SLC9A1CYP3A4ALKBH5 | |
| SCHEMBL588905 | 0.80 | TDP1 (0.44) | TSHRCYP1A2SLC9A1FTOMAPT | |
| SCHEMBL3864469 | 0.79 | CYP1A2 (0.65) | TSHRCYP1A2SLC9A1CYP3A4ALKBH5 | |
| SCHEMBL14784037 | 0.79 | CYP3A4 (0.39) | TSHRCYP1A2SLC9A1CYP3A4ALKBH5 | |
| SCHEMBL591832 | 0.78 | TDP1 (0.43) | TSHRCYP1A2SLC9A1FTOMAPT | |
| SCHEMBL26312990 | 0.74 | TDP1 (0.38) | TSHRMAPTKDM4EALDH1A1HSD17B10 | |
| SCHEMBL2518975 | 0.73 | TDP1 (0.43) | TSHRCYP1A2SLC9A1FTOMAPT | |
| Water SCHEMBL11775578 | 0.71 | TDP1 (0.41) | TSHRCYP1A2SLC9A1FTOMAPT | |
| SCHEMBL29153182 | 0.70 | ALDH1A1 (0.46) | TSHRCYP1A2CYP3A4MAPTKDM4E | |
| SCHEMBL3800959 | 0.70 | GABRP (0.41) | TSHRKDM4EALDH1A1HPGDTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1836175-B1 | FLUORESCENT PYRAZINE DERIVATIVES AND METHODS OF USING THE SAME IN ASSESSING RENAL FUNCTION | MALLINCKRODT INC (US) | 2010-04-28 | — | — | EP | disclosed |