Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.80 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.68 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.62 |
| ▸ | HTR2C | P28335 | 2/20 | 0.56 |
| ▸ | HTR1A | P08908 | 3/20 | 0.56 |
| ▸ | HTR1D | P28221 | 2/20 | 0.56 |
| ▸ | HTR1B | P28222 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | HTR7 | P34969 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | HTR5A | P47898 | 1/20 | 0.53 |
| ▸ | HTR6 | P50406 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | CDK2 | P24941 | 1/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL4349467 | 0.92 | NPC1 (0.68) | NPC1GPR84CYP2D6HTR2CHTR1A | |
| SCHEMBL12844152 | 0.89 | GPR84 (0.68) | NPC1GPR84CYP2D6HTR2CHTR1A | |
| SCHEMBL2161423 | 0.89 | GPR84 (0.76) | NPC1GPR84HTR2CHTR1AHTR1D | |
| SCHEMBL8806861 | 0.88 | GPR84 (0.67) | NPC1GPR84CYP2D6HTR2CHTR1A | |
| SCHEMBL27427278 | 0.88 | GPR84 (0.67) | NPC1GPR84CYP2D6HTR2CHTR1A | |
| SCHEMBL2534004 | 0.88 | HTR1A (0.73) | NPC1GPR84CYP2D6HTR2CHTR1A | |
| SCHEMBL22554662 | 0.87 | GPR84 (0.73) | NPC1GPR84HTR2CHTR1AHTR1D | |
| SCHEMBL29871648 | 0.87 | GPR84 (0.87) | NPC1GPR84HTR2CHTR1AHTR1D | |
| SCHEMBL28868186 | 0.85 | KMT2A (0.65) | NPC1GPR84CYP2D6HTR2CHTR1A | |
| SCHEMBL9263244 | 0.85 | GPR84 (0.64) | NPC1GPR84CYP2D6HTR2CHTR1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009047240-A1 | INDOLE DERIVATIVES USEFUL AS PPAR ACTIVATORS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-04-16 | — | — | WO | disclosed |
| WO-2009047240-A1 | INDOLE DERIVATIVES USEFUL AS PPAR ACTIVATORS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-04-16 | — | — | WO | disclosed |