Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 2/20 | 0.52 |
| ▸ | PDE7A | Q13946 | 3/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | RORC | P51449 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | PTPRC | P08575 | 2/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | S100A4 | P26447 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.40 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.40 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5900973 | 0.92 | VCAM1 (0.49) | VCAM1PDE7ASMN1; SMN2POLBPTPRC | |
| SCHEMBL2477528 | 0.82 | VCAM1 (0.74) | VCAM1PDE7AHSD17B10SMN1; SMN2KMT2A | |
| SCHEMBL7571256 | 0.74 | VCAM1 (0.47) | VCAM1SMN1; SMN2POLBPTPRCBCHE | |
| SCHEMBL1706658 | 0.73 | VCAM1 (0.59) | VCAM1SMN1; SMN2KMT2AALDH1A1MEN1 | |
| Dinitrophenylene SCHEMBL27564017 | 0.72 | VCAM1 (0.68) | VCAM1HSD17B10SMN1; SMN2ACHECES1 | |
| Dinitrophenylene SCHEMBL27864502 | 0.72 | TSHR (0.57) | VCAM1SMN1; SMN2ACHECES1CASP3 | |
| SCHEMBL689735 | 0.71 | VCAM1 (0.66) | VCAM1SMN1; SMN2CASP3SENP8SENP7 | |
| SCHEMBL2649876 | 0.70 | VCAM1 (0.49) | VCAM1SMN1; SMN2PTPRCBCHEACHE | |
| Nitrogen SCHEMBL28796067 | 0.70 | VCAM1 (0.64) | VCAM1SMN1; SMN2CASP3SENP8SENP7 | |
| SCHEMBL892830 | 0.70 | VCAM1 (1.00) | VCAM1HSD17B10SMN1; SMN2KMT2AALDH1A1 |
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-1233950-A4 | 3,4-DIHYDRO-(1H)QUINAZOLIN-2-ONE COMPOUNDS AS CSBP/P39 kINASE INHIBITORS | SMITHKLINE BEECHAM CORP (US) | 2003-03-26 | — | — | EP | disclosed |
| EP-1233950-A1 | 3,4-DIHYDRO-(1H)QUINAZOLIN-2-ONE COMPOUNDS AS CSBP/P39 kINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2002-08-28 | — | — | EP | disclosed |
| WO-2001038313-A1 | 3,4-DIHYDRO-(1H)QUINAZOLIN-2-ONE COMPOUNDS AS CSBP/p39 kINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (GB) | 2001-05-31 | — | — | WO | disclosed |