Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.44 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.44 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.44 |
| ▸ | FLT1 | P17948 | 1/20 | 0.44 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.44 |
| ▸ | KDR | P35968 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL14436163 | 0.88 | ALDH1A1 (0.51) | ALDH1A1CYP3A4TSHRRECQLMAPK1 | |
| SCHEMBL13400411 | 0.86 | TSHR (0.49) | ALDH1A1CYP3A4TSHRMAPK1TDP1 | |
| SCHEMBL5957215 | 0.86 | PDGFRB (0.56) | ALDH1A1CYP3A4TSHRRECQLMAPK1 | |
| SCHEMBL492505 | 0.84 | CYP1A2 (0.64) | ALDH1A1TSHRMAPK1L3MBTL1TDP1 | |
| SCHEMBL5201986 | 0.84 | LMNA (0.49) | ALDH1A1MAPK1L3MBTL1TDP1CYP1A2 | |
| SCHEMBL1695161 | 0.84 | EGFR (0.48) | ALDH1A1MAPK1TDP1CYP1A2PDGFRB | |
| SCHEMBL17675673 | 0.83 | MAPT (0.53) | ALDH1A1MAPK1TDP1CYP1A2PDGFRB | |
| SCHEMBL5917471 | 0.83 | CYP1A2 (0.44) | ALDH1A1CYP3A4MAPK1TDP1CYP1A2 | |
| SCHEMBL397593 | 0.83 | MEN1 (0.47) | ALDH1A1MAPK1L3MBTL1TDP1CYP1A2 | |
| SCHEMBL7052691 | 0.82 | LMNA (0.64) | ALDH1A1MAPK1PDGFRBFGFR1PDGFRA |
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 |
|---|---|---|---|---|---|---|---|
| US-6545035-B1 | Having effect on various kinases and cycline/CDK complexes and on the proliferation of various tumour cells. | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2003-04-08 | — | — | US | disclosed |
| US-6319918-B1 | FOR LYMPHOMA OR SOLID TUMORS TREATMENT | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2001-11-20 | — | — | US | disclosed |