Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 2/20 | 0.53 |
| ▸ | THRB | P10828 | 2/20 | 0.53 |
| ▸ | PTPN11 | Q06124 | 4/20 | 0.51 |
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.47 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.47 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.47 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.47 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.47 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.47 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL27733999 | 0.82 | CA12 (0.61) | THRATHRBTSHRLMNAALDH1A1 | |
| SCHEMBL8185682 | 0.81 | HSD17B10 (0.57) | THRATHRBPTPN11TSHRLMNA | |
| SCHEMBL10469517 | 0.80 | CA12 (0.62) | TSHRLMNAESR1NPC1RAB9A | |
| SCHEMBL31454401 | 0.79 | TSHR (0.60) | TSHRLMNAALDH1A1ESR1TP53 | |
| SCHEMBL668867 | 0.78 | TSHR (0.54) | TSHRLMNAALDH1A1ESR1TP53 | |
| SCHEMBL11333568 | 0.78 | TSHR (0.59) | PTPN11TSHRLMNAALDH1A1TP53 | |
| SCHEMBL166578 | 0.77 | PLA2G2A (0.47) | THRATHRBTSHRLMNAALDH1A1 | |
| SCHEMBL8185558 | 0.77 | ESR1 (0.51) | THRATHRBPTPN11TSHRLMNA | |
| SCHEMBL5215917 | 0.77 | TP53 (0.69) | TSHRLMNAALDH1A1TP53PLA2G4B | |
| SCHEMBL5219438 | 0.77 | TP53 (0.69) | TSHRLMNAALDH1A1TP53PLA2G4B |
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-0746339-A1 | X-RAY CONTRAST COMPOSITIONS CONTAINING CELLULOSE DERIVATIVES | NYCOMED IMAGING AS (NO) | 1996-12-11 | — | — | EP | disclosed |
| WO-1995022995-A1 | X-RAY CONTRAST COMPOSITIONS CONTAINING CELLULOSE DERIVATIVES | NYCOMED IMAGING A/S (NO) | 1995-08-31 | — | — | WO | disclosed |