Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.64 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.56 |
| ▸ | USP2 | O75604 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 7/20 | 0.56 |
| ▸ | NPC1 | O15118 | 6/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.54 |
| ▸ | HPGD | P15428 | 5/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | TP53 | P04637 | 2/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.54 |
| ▸ | RELA | Q04206 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8280938 | 0.83 | MAPT (0.49) | MAPTPTK2KDM4EUSP2RAB9A | |
| SCHEMBL5127949 | 0.81 | PTK2 (0.56) | MAPTPTK2KDM4EUSP2RAB9A | |
| SCHEMBL13074185 | 0.81 | MAPT (0.77) | MAPTPTK2KDM4EUSP2RAB9A | |
| SCHEMBL2088807 | 0.80 | MAPT (0.69) | MAPTPTK2KDM4EUSP2RAB9A | |
| SCHEMBL1221670 | 0.80 | MAPT (0.69) | MAPTKDM4EUSP2RAB9ANPC1 | |
| SCHEMBL8286974 | 0.80 | MAPT (0.69) | MAPTPTK2KDM4EUSP2RAB9A | |
| SCHEMBL13004548 | 0.78 | NPC1 (0.85) | MAPTKDM4EUSP2RAB9ANPC1 | |
| SCHEMBL21840702 | 0.75 | MAPT (0.77) | MAPTPTK2RAB9ANPC1KMT2A | |
| SCHEMBL29808127 | 0.74 | MAPT (0.58) | MAPTKDM4EUSP2RAB9ANPC1 | |
| SCHEMBL930892 | 0.74 | RAB9A (0.54) | MAPTUSP2RAB9ANPC1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005082866-A2 | SUBSTITUTED 1, 2, 4- TRIAZOLE DERIVATIVES AS OXYTOCIN ANTAGONISTS | PFIZER LIMITED (GB) | 2005-09-09 | — | — | WO | disclosed |