Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 10/20 | 0.38 |
| ▸ | PDGFRB | P09619 | 4/20 | 0.33 |
| ▸ | SRC | P12931 | 3/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.33 |
| ▸ | RET | P07949 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | RGS12 | O14924 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | GMNN | O75496 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | FYN | P06241 | 1/20 | 0.32 |
| ▸ | YES1 | P07947 | 1/20 | 0.32 |
| ▸ | LYN | P07948 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL6089219 | 1.00 | KDR (0.38) | KDRPDGFRBSRCFGFR1RET | |
| SCHEMBL6092488 | 0.81 | KDR (0.42) | KDRPDGFRBSRCFGFR1RET | |
| SCHEMBL6092492 | 0.81 | KDR (0.42) | KDRPDGFRBSRCFGFR1RET | |
| SCHEMBL6089126 | 0.81 | KDR (0.36) | KDRPDGFRBSRCFGFR1RET | |
| SCHEMBL6089131 | 0.81 | KDR (0.36) | KDRPDGFRBSRCFGFR1RET | |
| SCHEMBL6091900 | 0.81 | KDR (0.43) | KDRPDGFRBSRCFGFR1ALDH1A1 | |
| SCHEMBL6091902 | 0.81 | KDR (0.43) | KDRPDGFRBSRCFGFR1ALDH1A1 | |
| SCHEMBL6088527 | 0.79 | KDR (0.57) | KDRPDGFRBSRCFGFR1RET | |
| SCHEMBL6088523 | 0.79 | KDR (0.57) | KDRPDGFRBSRCFGFR1RET | |
| SCHEMBL6090046 | 0.79 | KDR (0.40) | KDRPDGFRBSRCFGFR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7060822-B1 | 2-pyrazolin-5-ones | ABBOTT GMBH & CO. KG (DE) | 2006-06-13 | — | — | US | disclosed |
| EP-1218373-A2 | 2-PYRAZOLIN-5-ONES AS TYROSINE KINASE INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 2002-07-03 | — | — | EP | disclosed |
| WO-2001009121-A2 | 2-PYRAZOLIN-5-ONES_AS TYROSINE KINASE INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 2001-02-08 | — | — | WO | disclosed |