Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KAT2B | Q92831 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | CASR | P41180 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CRHBP | P24387 | 1/20 | 0.34 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CTSD | P07339 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL2198711 | 0.86 | ALDH1A1 (0.42) | ALDH1A1CYP1A2TSHRKAT2BL3MBTL1 | |
| SCHEMBL9056707 | 0.81 | ALDH1A1 (0.45) | ALDH1A1CYP1A2TSHRKAT2BCASR | |
| SCHEMBL7533289 | 0.81 | ALDH1A1 (0.45) | ALDH1A1CYP1A2TSHRKAT2BCASR | |
| SCHEMBL2197778 | 0.81 | ADRB2 (0.35) | ALDH1A1TSHRKAT2BCRHBPCRHR2 | |
| SCHEMBL2202119 | 0.80 | ALDH1A1 (0.38) | ALDH1A1CYP1A2NPSR1HTTL3MBTL1 | |
| SCHEMBL2203139 | 0.80 | MMP2 (0.40) | ALDH1A1L3MBTL1GAASMN1; SMN2POLB | |
| SCHEMBL29362035 | 0.78 | MAOB (0.44) | ALDH1A1TSHRKAT2BNPSR1HTT | |
| SCHEMBL1130378 | 0.78 | MAOB (0.44) | ALDH1A1TSHRKAT2BNPSR1HTT | |
| SCHEMBL5583390 | 0.77 | ALDH1A1 (0.52) | ALDH1A1CYP1A2TSHRNPSR1CASR | |
| SCHEMBL5583367 | 0.76 | ALDH1A1 (0.51) | ALDH1A1CYP1A2TSHRNPSR1CASR |
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-0633502-B1 | PATTERN FORMING MATERIAL | CLARIANT FINANCE BVI LTD (VG) | 2002-03-20 | — | — | EP | disclosed |
| EP-0633502-A1 | PATTERN FORMING MATERIAL | HOECHST JAPAN LIMITED (JP) | 1995-01-11 | — | — | EP | disclosed |