Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 6/20 | 0.38 |
| ▸ | ITGA2B | P08514 | 6/20 | 0.38 |
| ▸ | ITGAV | P06756 | 4/20 | 0.38 |
| ▸ | FOS | P01100 | 1/20 | 0.35 |
| ▸ | JUN | P05412 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.33 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.32 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.32 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.32 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.32 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.32 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.32 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8431244 | 0.94 | ITGB3 (0.37) | ITGB3ITGA2BITGAVFOSJUN | |
| SCHEMBL8432903 | 0.89 | ITGB3 (0.39) | ITGB3ITGA2BITGAVFOSJUN | |
| SCHEMBL8429187 | 0.89 | ITGB3 (0.37) | ITGB3ITGA2BITGAVFOSJUN | |
| SCHEMBL8432521 | 0.88 | ABCB11 (0.41) | ITGB3ITGA2BITGAVFOSJUN | |
| SCHEMBL8428908 | 0.88 | ITGB3 (0.38) | ITGB3ITGA2BITGAVFOSJUN | |
| SCHEMBL8432815 | 0.86 | ITGB3 (0.40) | ITGB3ITGA2BITGAVFOSJUN | |
| SCHEMBL8532340 | 0.83 | PTGS1 (0.39) | CA1CA2ABCB11LMNAPTGS1 | |
| SCHEMBL8532447 | 0.80 | PTGS1 (0.40) | CA1CA2ABCB11LMNAPTGS1 | |
| SCHEMBL8429208 | 0.80 | SIRT1 (0.37) | ITGB3ITGA2BITGAVFOSJUN | |
| SCHEMBL8530525 | 0.79 | ABCB11 (0.54) | CA1CA2ABCB11LMNAPTGS1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5952381-A | SELECTIVELY INHIBITING OR ANTAGONIZING THE INTEGRINS; ANTITUMOR AGENTS, ANTIARTHRITIC AGENTS, VIRICIDES, MICROBIOCIDES; TREATING OSTEOPOROSIS, SKIN DISORDERS | G. D. SEARLE & CO. (US) | 1999-09-14 | — | — | US | disclosed |