Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 3/20 | 0.41 |
| ▸ | ITGAV | P06756 | 3/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.37 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.37 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | MITF | O75030 | 1/20 | 0.35 |
| ▸ | CPT1A | P50416 | 1/20 | 0.35 |
| ▸ | CPT1B | Q92523 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7339725 | 0.89 | ITGB3 (0.44) | ITGB3ITGAVITGA2BSMN1; SMN2ALDH1A1 | |
| SCHEMBL7349786 | 0.86 | ITGB3 (0.45) | ITGB3ITGAVITGA2BSMN1; SMN2ALDH1A1 | |
| SCHEMBL7345093 | 0.84 | HTT (0.39) | ITGB3ITGAVITGA2BLMNAMAPT | |
| SCHEMBL7343482 | 0.81 | SMN1; SMN2 (0.37) | ITGB3ITGAVITGA2BSMN1; SMN2ALDH1A1 | |
| SCHEMBL7340034 | 0.80 | LMNA (0.38) | ITGB3ITGAVITGA2BSMN1; SMN2ALDH1A1 | |
| SCHEMBL7339650 | 0.80 | HTT (0.39) | ITGB3ITGAVITGA2BSMN1; SMN2MAPT | |
| SCHEMBL7347348 | 0.79 | KMT2A (0.38) | ITGB3ITGAVITGA2BSMN1; SMN2ALDH1A1 | |
| SCHEMBL7347231 | 0.77 | LMNA (0.38) | ITGB3ITGAVITGA2BSMN1; SMN2ALDH1A1 | |
| SCHEMBL7340369 | 0.77 | HTT (0.39) | ITGB3ITGAVITGA2BSMN1; SMN2ALDH1A1 | |
| SCHEMBL7346220 | 0.77 | HTT (0.39) | ITGB3ITGAVITGA2BSMN1; SMN2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0850221-A1 | META-GUANIDINE, UREA, THIOUREA OR AZACYCLIC AMINO BENZOIC ACID DERIVATIVES AS INTEGRIN ANTAGONISTS | G.D. SEARLE & CO. (US) | 1998-07-01 | — | — | EP | claimed |
| WO-1997008145-A1 | META-GUANIDINE, UREA, THIOUREA OR AZACYCLIC AMINO BENZOIC ACID DERIVATIVES AS INTEGRIN ANTAGONISTS | G.D. SEARLE & CO. (US) | 1997-03-06 | — | — | WO | claimed |