Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 2/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.47 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | PLCG2 | P16885 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | HPGDS | O60760 | 1/20 | 0.38 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.38 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL798266 | 0.77 | PTGS2 (0.47) | ADORA1ADORA2AFGFR1MAPTSMN1; SMN2 | |
| SCHEMBL38658460 | 0.73 | FGFR1 (0.43) | FGFR1RAB9ASMN1; SMN2MEN1KMT2A | |
| SCHEMBL18341986 | 0.71 | CYP2A6 (0.46) | FGFR1MAPTRAB9AMEN1KMT2A | |
| SCHEMBL16902583 | 0.71 | NPC1 (0.38) | ADORA1ADORA2AMAPTRAB9ASMN1; SMN2 | |
| SCHEMBL27991340 | 0.69 | MAPT (0.51) | MAPTRAB9ASMN1; SMN2MEN1KMT2A | |
| SCHEMBL5268082 | 0.69 | ALDH1A1 (0.48) | ADORA1ADORA2AFGFR1MAPTRAB9A | |
| SCHEMBL23733792 | 0.69 | MAPT (0.50) | ADORA1ADORA2AMAPTRAB9ASMN1; SMN2 | |
| SCHEMBL27799881 | 0.69 | DPP4 (0.46) | ADORA1ADORA2AMAPTRAB9AMEN1 | |
| SCHEMBL656735 | 0.69 | IKBKB (0.44) | ADORA1ADORA2AMAPTRAB9ASMN1; SMN2 | |
| SCHEMBL28157573 | 0.68 | CYP1A2 (0.63) | ADORA2AMAPTRAB9ASMN1; SMN2MEN1 |
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-2616077-A1 | ANTI-CANCER ACTIVITY OF NOVEL BICYCLIC HETEROCYCLES | Katholieke Universiteit Leuven, K.U. Leuven R&D (BE) | 2013-07-24 | — | — | EP | disclosed |
| WO-2012035423-A1 | ANTI-CANCER ACTIVITY OF NOVEL BICYCLIC HETEROCYCLES | KATHOLIEKE UNIVERSITEIT LEUVEN, K.U. LEUVEN R&D (BE) | 2012-03-22 | — | — | WO | disclosed |