Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | BLM | P54132 | 2/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | EYA2 | O00167 | 1/20 | 0.37 |
| ▸ | APP | P05067 | 1/20 | 0.37 |
| ▸ | ACE | P12821 | 1/20 | 0.37 |
| ▸ | MVD | P53602 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2755866 | 0.86 | ALDH1A1 (0.39) | MAPK1ALDH1A1TSHRSLC6A2SLC6A4 | |
| SCHEMBL791874 | 0.85 | MAPK1 (0.38) | MAPK1ALDH1A1BLMPMP22HSD17B10 | |
| SCHEMBL5399954 | 0.80 | MLYCD (0.46) | MAPK1ALDH1A1HSD17B10TSHRSLC6A2 | |
| SCHEMBL22341298 | 0.78 | HDAC1 (0.35) | ALDH1A1TSHRSLC6A2SLC6A4KDM4E | |
| SCHEMBL8982368 | 0.78 | HDAC1 (0.35) | ALDH1A1TSHRSLC6A2SLC6A4KDM4E | |
| SCHEMBL19339624 | 0.77 | CA14 (0.38) | MAPK1ALDH1A1BLMPMP22HSD17B10 | |
| SCHEMBL6347011 | 0.77 | BLM (0.58) | MAPK1ALDH1A1BLMPMP22HSD17B10 | |
| SCHEMBL562838 | 0.77 | BLM (0.64) | MAPK1ALDH1A1BLMPMP22HSD17B10 | |
| SCHEMBL1950012 | 0.77 | HDAC1 (0.35) | MAPK1ALDH1A1TSHRSLC6A2SLC6A4 | |
| SCHEMBL18274589 | 0.77 | MLYCD (0.37) | ALDH1A1HSD17B10TSHRSLC6A2SLC6A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6417396-B1 | BY-PRODUCT INHIBITION; REACTING ORGANIC ALKALI OR ALKALINE EARTH METAL CARBOXYLATE, PHOSPHONATE, OR SULFONATE; ACYLATION, PHOSPHORYLATION, SULFONATION, AMIDATION, ALKYLATION, CYCLIZATION, OR CONDENSATION | Lambert, Warner | 2002-07-09 | — | — | US | disclosed |
| US-6395930-B1 | AMINE SULFIDE PHOSPHATE OR SULFATE REAGENTS | WARNER LAMBERT | 2002-05-28 | — | — | US | disclosed |
| US-6121488-A | Quenching reagents for solution phase synthesis | WARNER-LAMBERT COMPANY (US) | 2000-09-19 | — | — | US | disclosed |