Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.41 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | MITF | O75030 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL12426299 | 0.82 | MAPT (0.45) | PTGS1PTGS2NPSR1L3MBTL1ALDH1A1 | |
| SCHEMBL12426140 | 0.79 | TGFBR1 (0.61) | NPSR1L3MBTL1USP2ALDH1A1HPGD | |
| SCHEMBL14504731 | 0.79 | PDE4B (0.42) | PTGS1PTGS2NPSR1L3MBTL1USP2 | |
| SCHEMBL12426378 | 0.74 | IDO1 (0.48) | PTGS1PTGS2NPSR1ALDH1A1HPGD | |
| SCHEMBL14441710 | 0.73 | IDO1 (0.42) | NPSR1HPGDADORA2AADORA1NR1I3 | |
| SCHEMBL20150033 | 0.72 | NR1I3 (0.57) | L3MBTL1RAB9ANPC1ADORA2AADORA1 | |
| SCHEMBL30035200 | 0.72 | NR1I3 (0.57) | L3MBTL1RAB9ANPC1ADORA2AADORA1 | |
| SCHEMBL15477947 | 0.72 | NR1I3 (0.57) | L3MBTL1RAB9ANPC1ADORA2AADORA1 | |
| SCHEMBL18158898 | 0.71 | NR1I3 (0.45) | NPSR1ALDH1A1HPGDHSD17B10RAB9A | |
| SCHEMBL30986826 | 0.70 | NR1I3 (0.55) | L3MBTL1ALDH1A1HPGDRAB9ANPC1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7977342-B2 | HCV inhibiting bi-cyclic pyrimidines | TIBOTEC-VIRCO VIROLOGY BVBA (BE) | 2011-07-12 | — | — | US | disclosed |
| US-7977342-B2 | HCV inhibiting bi-cyclic pyrimidines | TIBOTEC-VIRCO VIROLOGY BVBA (BE) | 2011-07-12 | — | — | US | disclosed |
| US-7223766-B2 | Bi-cyclic pyrimidine inhibitors of TGFβ | SCIOS, INC. (US) | 2007-05-29 | — | — | US | disclosed |
| US-7223766-B2 | Bi-cyclic pyrimidine inhibitors of TGFβ | SCIOS, INC. (US) | 2007-05-29 | — | — | US | disclosed |