Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.52 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.52 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | SOAT2 | O75908 | 1/20 | 0.46 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | FAAH | O00519 | 3/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.44 |
| ▸ | CNR1 | P21554 | 2/20 | 0.44 |
| ▸ | CNR2 | P34972 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6736087 | 1.00 | ALDH1A1 (0.58) | ALDH1A1PRSS1PRSS2PRSS3TSHR | |
| SCHEMBL27789877 | 1.00 | ALDH1A1 (0.58) | ALDH1A1PRSS1PRSS2PRSS3TSHR | |
| SCHEMBL6729570 | 0.93 | ALDH1A1 (0.64) | ALDH1A1PRSS1PRSS2PRSS3TSHR | |
| SCHEMBL6729581 | 0.93 | ALDH1A1 (0.64) | ALDH1A1PRSS1PRSS2PRSS3TSHR | |
| SCHEMBL28228536 | 0.92 | PRSS1 (0.57) | ALDH1A1PRSS1PRSS2PRSS3TSHR | |
| SCHEMBL81277 | 0.91 | ALDH1A1 (0.67) | ALDH1A1PRSS1PRSS2PRSS3TSHR | |
| SCHEMBL455374 | 0.91 | ALDH1A1 (0.67) | ALDH1A1PRSS1PRSS2PRSS3TSHR | |
| SCHEMBL4197066 | 0.91 | ALDH1A1 (0.67) | ALDH1A1PRSS1PRSS2PRSS3TSHR | |
| SCHEMBL4185479 | 0.91 | ALDH1A1 (0.67) | ALDH1A1PRSS1PRSS2PRSS3TSHR | |
| SCHEMBL1191451 | 0.91 | ALDH1A1 (0.67) | ALDH1A1PRSS1PRSS2PRSS3TSHR |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1124893-B1 | POLYISOCYANATE POLYADDITION PRODUCTS | BASF AG (DE) | 2004-12-22 | — | — | EP | disclosed |
| US-20040209969-A1 | Polyisocyanate polyaddition products | ARLT ANDREAS | 2004-10-21 | — | — | US | disclosed |
| US-6794421-B2 | comprising hydrophobic compounds plus at least one further compound and/or derivative thereof reactive toward primary amines, compound being selected from cyclic sulfonic esters and sulfones and mixtures thereof | BASF AKTIENGESELLSCHAFT (DE) | 2004-09-21 | — | — | US | disclosed |
| US-20030130366-A1 | Polyisocyanate polyaddition products | ARLT ANDREAS (DE) | 2003-07-10 | — | — | US | disclosed |
| US-6495611-B1 | MATTRESS OR FURNITURE UPHOLSTERY OR CARPET BACKING COMPRISING A FLEXIBLE POLYURETHANE FOAM COMPRISING HYDROPHOBIC COMPOUNDS PLUS AT LEAST ONE CYCLODEXTRIN, RESORCINARENE, CYCLOPHANE AND/OR CYCLOCALIXARENE | BASF AKTIENGESELLSCHAFT (DE) | 2002-12-17 | — | — | US | disclosed |