Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.43 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.40 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.40 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 2/20 | 0.40 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.39 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10286193 | 0.81 | KMT2A (0.46) | NPY5RKMT2AMEN1ALDH1A1IDO1 | |
| SCHEMBL4491486 | 0.81 | HPGD (0.53) | TAAR1NPY5RKMT2AEGFRL3MBTL1 | |
| SCHEMBL30137212 | 0.80 | TAAR1 (0.52) | TAAR1AOC3PYCR1ALDH1A1 | |
| SCHEMBL9261232 | 0.80 | TAAR1 (0.52) | TAAR1AOC3KMT2AEGFRERBB2 | |
| SCHEMBL4349128 | 0.79 | NPY5R (0.43) | NPY5RALDH1A1LOXL2USP2HPGD | |
| SCHEMBL3174757 | 0.78 | HSP90AA1 (0.57) | NPY5RAOC3KMT2AMEN1ALDH1A1 | |
| SCHEMBL6180312 | 0.78 | RORC (0.48) | NPY5RRORCUSP2HPGDHSD17B10 | |
| SCHEMBL14039609 | 0.76 | HSD17B10 (0.45) | NPY5RALDH1A1RORCUSP2HPGD | |
| SCHEMBL4403151 | 0.76 | KCNH2 (0.44) | BCHEACHEALDH1A1 | |
| SCHEMBL777188 | 0.76 | KMT2A (0.44) | TAAR1KMT2AEGFRERBB2L3MBTL1 |
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-1995009158-A1 | TRICYCLIC DERIVATIVES | ZENECA LIMITED (GB) | 1995-04-06 | — | — | WO | disclosed |
| WO-1994007869-A1 | QUINAZOLINE DERIVATIVES | ZENECA LIMITED (GB) | 1994-04-14 | — | — | WO | disclosed |