Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
| ▸ | CASP7 | P55210 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | AHR | P35869 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.46 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.46 |
| ▸ | ESR1 | P03372 | 2/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.46 |
| ▸ | ABL1 | P00519 | 1/20 | 0.46 |
| ▸ | TTR | P02766 | 1/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7515036 | 1.00 | SMN1; SMN2 (0.48) | SMN1; SMN2ALDH1A1HPGDTP53MAPT | |
| SCHEMBL7518829 | 0.79 | PTGS1 (0.39) | ALDH1A1HPGDMAPTPTGS2TUBB4A | |
| SCHEMBL7520340 | 0.79 | MAOB (0.46) | HSD17B10AHRCYP1A2NFE2L2RAB9A | |
| SCHEMBL7518821 | 0.79 | PTGS1 (0.39) | ALDH1A1HPGDMAPTPTGS2TUBB4A | |
| SCHEMBL7523379 | 0.78 | MAOB (0.42) | SMN1; SMN2ALDH1A1HPGDMAPTTRPA1 | |
| SCHEMBL7523377 | 0.78 | MAOB (0.42) | SMN1; SMN2ALDH1A1HPGDMAPTTRPA1 | |
| SCHEMBL7522363 | 0.76 | ATM (0.51) | SMN1; SMN2ALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL7522354 | 0.76 | ATM (0.51) | SMN1; SMN2ALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL4881152 | 0.73 | RELA (0.81) | SMN1; SMN2ALDH1A1HPGDTP53MAPT | |
| SCHEMBL631998 | 0.73 | RELA (0.81) | SMN1; SMN2ALDH1A1HPGDTP53MAPT |
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-1173420-A2 | HETEROCYCLIC COMPOUNDS HAVING ANTITUMOR ACTIVITY | Novuspharma S.p.A. (IT) | 2002-01-23 | — | — | EP | disclosed |
| WO-2000053581-A2 | HETEROCYCLIC COMPOUNDS HAVING ANTITUMOR ACTIVITY | NOVUSPHARMA S.P.A. (IT) | 2000-09-14 | — | — | WO | disclosed |