Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.74 |
| ▸ | NPC1 | O15118 | 5/20 | 0.74 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.74 |
| ▸ | NPBWR1 | P48145 | 2/20 | 0.54 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | BLM | P54132 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | MITF | O75030 | 1/20 | 0.48 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | XBP1 | P17861 | 1/20 | 0.48 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL31277650 | 0.85 | NPC1 (1.00) | RAB9ANPC1PAX8NPBWR1MCHR1 | |
| SCHEMBL18446084 | 0.85 | RAB9A (0.78) | RAB9ANPC1PAX8NPBWR1MCHR1 | |
| SCHEMBL3031931 | 0.85 | NPC1 (1.00) | RAB9ANPC1PAX8NPBWR1MCHR1 | |
| SCHEMBL10672542 | 0.83 | RAB9A (0.58) | RAB9ANPC1PAX8NPBWR1MCHR1 | |
| Pyrazon SCHEMBL1858918 | 0.82 | RAB9A (0.70) | RAB9ANPC1PAX8KMT2AHTT | |
| Pyrazon SCHEMBL53824 | 0.82 | RAB9A (0.70) | RAB9ANPC1PAX8KMT2AHTT | |
| SCHEMBL11785004 | 0.81 | RAB9A (0.67) | RAB9ANPC1PAX8NPBWR1MCHR1 | |
| SCHEMBL13219325 | 0.81 | RAB9A (0.71) | RAB9ANPC1PAX8NPBWR1MCHR1 | |
| SCHEMBL29776941 | 0.80 | NPC1 (0.56) | RAB9ANPC1PAX8NPBWR1MCHR1 | |
| SCHEMBL17619445 | 0.79 | KMT2A (0.57) | RAB9ANPC1PAX8NPBWR1MCHR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9562019-B2 | Substituted pyridazines as EGFR and/or KRAS inhibitors | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 2017-02-07 | — | — | US | disclosed |
| EP-2518063-B1 | Pyridazinones and furan-containing compounds | SLOAN-KETTERING INST FOR CANCER RES (US) | 2017-02-01 | — | — | EP | disclosed |