Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100A4 | P26447 | 2/20 | 0.37 |
| ▸ | MAP2K7 | O14733 | 1/20 | 0.37 |
| ▸ | CDC25A | P30304 | 1/20 | 0.37 |
| ▸ | CDC25B | P30305 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 4/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8409656 | 0.81 | ALDH1A1 (0.38) | S100A4MAP2K7CDC25ACDC25BALDH1A1 | |
| SCHEMBL16044746 | 0.78 | ALDH1A1 (0.40) | MAP2K7CDC25ACDC25BMAPTALDH1A1 | |
| SCHEMBL29415231 | 0.78 | ALDH1A1 (0.40) | MAP2K7CDC25ACDC25BMAPTALDH1A1 | |
| SCHEMBL8734853 | 0.78 | ALDH1A1 (0.33) | S100A4MAP2K7CDC25ACDC25BMAPT | |
| SCHEMBL8409788 | 0.77 | HPGD (0.32) | S100A4MAP2K7CDC25ACDC25BMAPT | |
| SCHEMBL8409658 | 0.77 | MAP2K7 (0.34) | S100A4MAP2K7CDC25ACDC25BMAPT | |
| SCHEMBL8732820 | 0.77 | ALDH1A1 (0.32) | S100A4MAP2K7CDC25ACDC25BMAPT | |
| SCHEMBL8732437 | 0.77 | ALDH1A1 (0.32) | S100A4MAP2K7CDC25ACDC25BMAPT | |
| SCHEMBL8412724 | 0.76 | PKM (0.32) | S100A4MAP2K7CDC25ACDC25BMAPT | |
| SCHEMBL8732833 | 0.75 | ALDH1A1 (0.32) | MAPTALDH1A1HPGDTDP1PKM |
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 |
|---|---|---|---|---|---|---|---|
| EP-0708087-B1 | Method for making a substituted benzene compound | ROHM & HAAS (US) | 1999-07-28 | — | — | EP | disclosed |
| US-5670691-A | REACTION OF 2-SUBSTITUTED BENZENESULFONATE WITH LITHIUM COMPOUND THEN REACTION WITH ELECTROPHILE TO FORM 2,6-DISUBSTITUTED BENZENESULFONATE | ROHM AND HAAS COMPANY (US) | 1997-09-23 | — | — | US | disclosed |
| EP-0708087-A1 | Method for making a substituted benzene compound | ROHM AND HAAS COMPANY (US) | 1996-04-24 | — | — | EP | disclosed |