Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 5/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NFKBIA | P25963 | 1/20 | 0.40 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | THRA | P10827 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL34463904 | 0.81 | HCAR3 (0.64) | VCAM1ALDH1A1TSHRCA12CA9 | |
| SCHEMBL9796226 | 0.80 | CYP3A4 (0.55) | VCAM1ALDH1A1TSHRCYP3A4MCOLN3 | |
| SCHEMBL11442096 | 0.78 | VCAM1 (0.47) | VCAM1ALDH1A1TSHRCYP3A4MCOLN3 | |
| SCHEMBL1368484 | 0.78 | TSHR (0.51) | ALDH1A1TSHRCYP3A4MCOLN3TDP1 | |
| SCHEMBL9796228 | 0.75 | VCAM1 (0.72) | VCAM1ALDH1A1MCOLN3CA12CA9 | |
| SCHEMBL4067424 | 0.75 | TSHR (0.60) | VCAM1TSHRCYP3A4MCOLN3TDP1 | |
| SCHEMBL10619019 | 0.75 | TSHR (0.60) | VCAM1TSHRCYP3A4MCOLN3TDP1 | |
| SCHEMBL13717956 | 0.75 | VCAM1 (0.55) | VCAM1ALDH1A1TSHRCYP3A4TDP1 | |
| SCHEMBL23532651 | 0.74 | CA1 (0.52) | VCAM1ALDH1A1CA12CA9CA1 | |
| SCHEMBL30029237 | 0.74 | CA1 (0.52) | VCAM1ALDH1A1CA12CA9CA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4990523-A | Treatment of chronic inflammatory joint disease with arylsulfonamides | A. H. ROBINS COMPANY, INCORPORATED (US) | 1991-02-05 | — | — | US | disclosed |
| WO-1990015600-A2 | TREATMENT OF CHRONIC INFLAMMATORY JOINT DISEASE WITH ARYLSULFONAMIDES | A.H. ROBINS COMPANY, INCORPORATED (US) | 1990-12-27 | — | — | WO | disclosed |