Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | DHODH | Q02127 | 3/20 | 0.36 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14996189 | 0.92 | CYP1A2 (0.39) | NPC1RAB9ADHODHCYP1A2CYP2D6 | |
| SCHEMBL14996193 | 0.90 | NPC1 (0.50) | NPC1RAB9ADHODHMAP2K4SMN1; SMN2 | |
| SCHEMBL8033819 | 0.86 | NPC1 (0.42) | NPC1RAB9ADHODHSMN1; SMN2DCTPP1 | |
| SCHEMBL8019842 | 0.85 | POLB (0.39) | NPC1RAB9ACYP1A2CYP2D6TP53 | |
| SCHEMBL14996188 | 0.85 | NPC1 (0.38) | NPC1RAB9ADHODHSMN1; SMN2CYP1A2 | |
| SCHEMBL8020266 | 0.84 | NPC1 (0.40) | NPC1RAB9ADHODHSMN1; SMN2CYP3A4 | |
| SCHEMBL8029354 | 0.84 | KCNN4 (0.38) | NPC1RAB9ASMN1; SMN2TP53HTR2B | |
| SCHEMBL13002498 | 0.83 | NPC1 (0.39) | NPC1RAB9ADHODHDCTPP1CYP1A2 | |
| SCHEMBL8028113 | 0.82 | NPC1 (0.40) | NPC1RAB9ADHODHCYP1A2CYP2D6 | |
| SCHEMBL8033068 | 0.81 | NPC1 (0.37) | NPC1RAB9ADHODHCYP1A2CYP2D6 |
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-2250157-B1 | NOVEL HETEROCYCLIC COMPOUNDS | PANACEA BIOTEC LTD (IN) | 2014-11-05 | — | — | EP | disclosed |
| US-8455479-B2 | Heterocyclic compounds | PANACEA BIOTEC LIMITED (IN) | 2013-06-04 | — | — | US | disclosed |
| WO-2009093269-A1 | NOVEL HETEROCYCLIC COMPOUNDS | PANACEA BIOTEC LIMITED (IN) | 2009-07-30 | — | — | WO | disclosed |