Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | IDH1 | O75874 | 3/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | CTSB | P07858 | 1/20 | 0.31 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.31 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.31 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.31 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4506959 | 1.00 | NPC1 (0.35) | NPC1RAB9AMEN1KMT2AATM | |
| SCHEMBL4513365 | 0.91 | NPC1 (0.34) | NPC1RAB9AMEN1KMT2AATM | |
| SCHEMBL4515171 | 0.91 | LTA4H (0.36) | NPC1RAB9AMEN1KMT2AATM | |
| SCHEMBL5332762 | 0.90 | ALDH1A1 (0.32) | NPC1RAB9AMEN1KMT2AATM | |
| SCHEMBL4520572 | 0.90 | ALDH1A1 (0.32) | NPC1RAB9AMEN1KMT2AATM | |
| SCHEMBL4229805 | 0.89 | NPC1 (0.33) | NPC1RAB9AMEN1KMT2AATM | |
| SCHEMBL4516372 | 0.85 | P2RX3 (0.34) | IDH1KDM4C | |
| SCHEMBL4516368 | 0.85 | P2RX3 (0.34) | IDH1KDM4C | |
| SCHEMBL5335041 | 0.84 | KDM4C (0.40) | IDH1KDM4C | |
| SCHEMBL4509181 | 0.84 | KDM4C (0.40) | IDH1KDM4C |
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-2007029062-A2 | NOVEL PYRIDINE DERIVATIVES | ORCHID RESEARCH LABORATORIES LIMITED (IN) | 2007-03-15 | — | — | WO | claimed |
| WO-2007029062-A2 | NOVEL PYRIDINE DERIVATIVES | ORCHID RESEARCH LABORATORIES LIMITED (IN) | 2007-03-15 | — | — | WO | disclosed |