Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.48 |
| ▸ | MPO | P05164 | 3/20 | 0.46 |
| ▸ | XDH | P47989 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.40 |
| ▸ | WEE1 | P30291 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CDK1 | P06493 | 1/20 | 0.39 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.39 |
| ▸ | RXRA | P19793 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.39 |
| ▸ | CDK4 | P11802 | 1/20 | 0.39 |
| ▸ | PRKACA | P17612 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2732040 | 0.83 | MPO (0.67) | TSHRALDH1A1HSD17B10HTTRXFP1 | |
| SCHEMBL16844164 | 0.72 | MPO (0.70) | ALDH1A1HSD17B10HTTMPOXDH | |
| SCHEMBL10288918 | 0.72 | MPO (0.68) | ALDH1A1MPOXDHKMT2A | |
| SCHEMBL10289262 | 0.69 | ALDH1A1 (0.60) | TSHRALDH1A1HSD17B10RXFP1XDH | |
| SCHEMBL10288919 | 0.68 | MPO (0.67) | ALDH1A1MPOXDHKMT2A | |
| SCHEMBL11014001 | 0.68 | DDR1 (0.40) | ALDH1A1HSD17B10MEN1KMT2A | |
| SCHEMBL10289176 | 0.68 | MPO (0.65) | ALDH1A1MPOXDHKMT2A | |
| SCHEMBL11009548 | 0.67 | HPGD (0.40) | ALDH1A1CA12 | |
| SCHEMBL12713478 | 0.66 | MPO (0.76) | TSHRALDH1A1HSD17B10HTTRXFP1 | |
| SCHEMBL10289180 | 0.63 | MPO (1.00) | TSHRALDH1A1MPOXDHMEN1 |
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-2012058211-A2 | QUINAZOLINE DERIVATIVES, COMPOSITIONS, AND USES RELATED THERETO | EMORY UNIVERSITY (US) | 2012-05-03 | — | — | WO | disclosed |