Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | RARB | P10826 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.43 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.43 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Urea SCHEMBL27771105 | 0.92 | TSHR (0.59) | TSHRCYP3A4ALDH1A1CES2MAPT | |
| Urea SCHEMBL8373138 | 0.92 | TSHR (0.59) | TSHRCYP3A4ALDH1A1CES2MAPT | |
| Urea SCHEMBL27787737 | 0.90 | TSHR (0.56) | TSHRCYP3A4ALDH1A1CES2MAPT | |
| Urea SCHEMBL27645725 | 0.90 | TSHR (0.56) | TSHRCYP3A4ALDH1A1CES2MAPT | |
| Urea SCHEMBL28059895 | 0.87 | TSHR (0.54) | TSHRCYP3A4ALDH1A1CES2MAPT | |
| Urea SCHEMBL11028992 | 0.87 | TSHR (0.54) | TSHRCYP3A4ALDH1A1CES2MAPT | |
| Acetic Acid SCHEMBL37245 | 0.86 | TSHR (0.59) | TSHRCYP3A4ALDH1A1CES2MAPT | |
| Acetic Acid SCHEMBL9616198 | 0.86 | TSHR (0.59) | TSHRCYP3A4ALDH1A1CES2MAPT | |
| Acetic Acid SCHEMBL28723481 | 0.86 | TSHR (0.59) | TSHRCYP3A4ALDH1A1CES2MAPT | |
| Oxalic Acid SCHEMBL27852342 | 0.86 | TSHR (0.59) | TSHRCYP3A4ALDH1A1CES2MAPT |
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-0730585-A1 | ETHERIFIED ALKYL OR ARYLCARBAMYLMETHYLATED AMINOTRIAZINES AND CURABLE COMPOSITIONS CONTAINING THE SAME | PPG INDUSTRIES, INC. (US) | 1996-09-11 | — | — | EP | disclosed |
| WO-1995014677-A1 | ETHERIFIED ALKYL OR ARYLCARBAMYLMETHYLATED AMINOTRIAZINES AND CURABLE COMPOSITIONS CONTAINING THE SAME | PPG INDUSTRIES, INC. (US) | 1995-06-01 | — | — | WO | disclosed |