Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 13/20 | 0.36 |
| ▸ | CA2 | P00918 | 13/20 | 0.36 |
| ▸ | CA9 | Q16790 | 7/20 | 0.35 |
| ▸ | CA12 | O43570 | 6/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.35 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | F2 | P00734 | 2/20 | 0.33 |
| ▸ | TMPRSS6 | Q8IU80 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | MPI | P34949 | 1/20 | 0.33 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8531517 | 0.85 | ITGB3 (0.35) | CA1CA2CA9CA12ITGB3 | |
| SCHEMBL8536201 | 0.84 | ITGB3 (0.35) | CA1CA2CA9CA12ITGB3 | |
| SCHEMBL8536127 | 0.75 | CA1 (0.35) | CA1CA2CA9CA12MAPT | |
| Propionic Acid SCHEMBL8534857 | 0.73 | USP28 (0.40) | CA1CA2CA9CA12MAPT | |
| SCHEMBL8499992 | 0.73 | MEN1 (0.42) | CA1CA2ITGB3ITGA2BMAPT | |
| SCHEMBL8531518 | 0.72 | CA1 (0.34) | CA1CA2CA9CA12MAPT | |
| SCHEMBL8428884 | 0.70 | ITGB3 (0.42) | CA1CA2CA9CA12ITGB3 | |
| SCHEMBL8501204 | 0.69 | PTGER1 (0.42) | CA1CA2CA9CA12ITGB3 | |
| SCHEMBL8532458 | 0.67 | ITGB3 (0.40) | ITGB3ITGA2BMAPT | |
| SCHEMBL7376447 | 0.66 | MAPT (0.47) | ITGB3ITGA2BMAPTKMT2AMEN1 |
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-5773646-A | INTEGRIN INHIBITORS | G. D. SEARLE & CO. (US) | 1998-06-30 | — | — | US | disclosed |