Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 7/20 | 0.51 |
| ▸ | MTNR1B | P49286 | 7/20 | 0.51 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | ACACB | O00763 | 3/20 | 0.48 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.43 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CASP3 | P42574 | 2/20 | 0.41 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.41 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.41 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9512709 | 0.83 | MTNR1A (0.67) | MTNR1AMTNR1BSMN1; SMN2ACACBTRPV1 | |
| SCHEMBL19307951 | 0.75 | RXFP1 (0.54) | RXFP1SMN1; SMN2DGAT1NPC1RAB9A | |
| SCHEMBL9607431 | 0.72 | RXFP1 (0.51) | RXFP1SMN1; SMN2NPC1RAB9ACASP3 | |
| SCHEMBL256524 | 0.72 | ACACB (0.81) | ACACB | |
| SCHEMBL12001056 | 0.72 | ACACB (0.78) | ACACB | |
| SCHEMBL12001227 | 0.71 | ACACB (0.70) | ACACB | |
| SCHEMBL8581724 | 0.71 | AOC3 (0.63) | MTNR1AMTNR1BSMN1; SMN2ACACBNPC1 | |
| SCHEMBL9513697 | 0.71 | ACACB (0.61) | MTNR1AMTNR1BSMN1; SMN2ACACBRAB9A | |
| SCHEMBL12001213 | 0.71 | ACACB (0.67) | ACACB | |
| SCHEMBL3823662 | 0.70 | P2RX7 (0.47) | ACACB |
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-2448584-A1 | SUBSTITUTED 4-HYDROXYPYRIMIDINE-5-CARBOXAMIDES | Merck Sharp & Dohme Corp. (US) | 2012-05-09 | — | — | EP | disclosed |
| WO-2011002624-A1 | SUBSTITUTED 4-HYDROXYPYRIMIDINE-5-CARBOXAMIDES | MERCK SHARP & DOHME CORP. (US) | 2011-01-06 | — | — | WO | disclosed |