Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.36 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MMP1 | P03956 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP3 | P08254 | 1/20 | 0.32 |
| ▸ | MMP8 | P22894 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8769833 | 0.80 | TSHR (0.51) | TSHRMEN1KMT2ACYP3A4TDP1 | |
| SCHEMBL9482612 | 0.80 | CYP3A4 (0.39) | TSHRMEN1KMT2ACYP3A4TDP1 | |
| SCHEMBL1683063 | 0.80 | ALDH1A1 (0.45) | TSHRMEN1KMT2ACYP3A4TDP1 | |
| SCHEMBL21445866 | 0.79 | TSHR (0.42) | TSHRMEN1KMT2ACYP3A4TDP1 | |
| SCHEMBL9488110 | 0.79 | LMNA (0.55) | TSHRCYP3A4POLBLMNAHSD17B10 | |
| SCHEMBL797852 | 0.77 | — | — | |
| SCHEMBL10893713 | 0.77 | CYP3A4 (0.37) | TSHRCYP3A4TDP1MAPTCACNA1B | |
| SCHEMBL11300446 | 0.77 | ALDH1A1 (0.40) | MEN1KMT2ALMNAHSD17B10ALDH1A1 | |
| SCHEMBL1836431 | 0.76 | TSHR (0.40) | TSHRMEN1KMT2ACYP3A4TDP1 | |
| SCHEMBL10690119 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5200547-A | From amine or alcohol with carbon dioxide and allyl halide | MONSANTO COMPANY (US) | 1993-04-06 | — | — | US | disclosed |
| EP-0477159-A1 | Preparation of urethane and carbonate products | MONSANTO COMPANY (US) | 1992-03-25 | — | — | EP | disclosed |