Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | NAAA | Q02083 | 1/20 | 0.42 |
| ▸ | CES2 | O00748 | 3/20 | 0.36 |
| ▸ | CES1 | P23141 | 3/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | DNM1 | Q05193 | 5/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Dodecane SCHEMBL4614619 | 1.00 | TSHR (0.44) | TSHRTHRBNAAACES2CES1 | |
| Hexane SCHEMBL6756710 | 0.97 | TSHR (0.39) | TSHRTHRBNAAACES2CES1 | |
| Hexane SCHEMBL3357674 | 0.97 | TSHR (0.39) | TSHRTHRBNAAACES2CES1 | |
| Pentane SCHEMBL5376888 | 0.92 | TSHR (0.41) | TSHRTHRBNAAALMNA | |
| Butane SCHEMBL2777225 | 0.85 | TSHR (0.33) | TSHR | |
| SCHEMBL9571006 | 0.82 | FDPS (0.32) | CES2 | |
| SCHEMBL10791564 | 0.81 | NAAA (0.58) | TSHRTHRBNAAACES2CES1 | |
| SCHEMBL37419 | 0.81 | NAAA (0.58) | TSHRTHRBNAAACES2CES1 | |
| SCHEMBL10870593 | 0.81 | NAAA (0.58) | TSHRTHRBNAAACES2CES1 | |
| SCHEMBL1493031 | 0.81 | NAAA (0.58) | TSHRTHRBNAAACES2CES1 |
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-6797771-B2 | Aqueous composition that can be hardened physically, thermally or thermally and with actinic radiation and the derivatives and production thereof | BASF COATINGS AG (DE) | 2004-09-28 | — | — | US | disclosed |
| US-20030100626-A1 | Aqueous composition that can be hardened physically, thermally or thermally and with actinic radiation and the derivatives and production thereof | BASF COATINGS AKTIENGESELLSCHAFT (DE) | 2003-05-29 | — | — | US | disclosed |