Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 1/20 | 0.44 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.42 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.42 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL18392045 | 0.94 | MTNR1A (0.43) | PTGESHSD17B1HSD17B2MTNR1AMTNR1B | |
| SCHEMBL8943802 | 0.89 | PTGES (0.51) | PTGESCYP1A1CYP1A2CYP1B1NPC1 | |
| SCHEMBL9163037 | 0.86 | SLC16A3 (0.43) | HSD17B1HSD17B2MTNR1AMTNR1BNFE2L2 | |
| SCHEMBL8943935 | 0.85 | PTGES (0.51) | PTGESCYP1A1CYP1A2CYP1B1ALDH1A1 | |
| SCHEMBL23350491 | 0.85 | ALDH1A1 (0.41) | HSD17B1HSD17B2MTNR1AMTNR1BMEN1 | |
| SCHEMBL28209766 | 0.84 | MTNR1A (0.49) | HSD17B1HSD17B2MTNR1AMTNR1BENPP2 | |
| SCHEMBL13385303 | 0.84 | CA4 (0.52) | HSD17B1HSD17B2MTNR1AMTNR1BENPP2 | |
| SCHEMBL8944101 | 0.84 | HSD17B2 (0.50) | HSD17B1HSD17B2MTNR1AMTNR1BENPP2 | |
| SCHEMBL8944319 | 0.83 | CA12 (0.46) | NFE2L2CYP1A1CYP1A2CYP1B1MEN1 | |
| SCHEMBL19275049 | 0.82 | CA1 (0.48) | PTGESENPP2CYP1A2MEN1ALDH1A1 |
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-1354887-B1 | Ligands for metals and improved metal-catalyzed processes based thereon | MASSACHUSETTS INST TECHNOLOGY (US) | 2007-04-25 | — | — | EP | disclosed |
| EP-1354887-B1 | Ligands for metals and improved metal-catalyzed processes based thereon | MASSACHUSETTS INST TECHNOLOGY (US) | 2007-04-25 | — | — | EP | disclosed |
| EP-1097158-B1 | LIGANDS FOR METALS AND METAL-CATALYZED PROCESSES | MASSACHUSETTS INST TECHNOLOGY (US) | 2006-01-25 | — | — | EP | disclosed |