Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | BRD4 | O60885 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 4/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30842828 | 0.86 | ALDH1A1 (0.48) | ALDH1A1HPGDPOLBCYP2C19NAPRT | |
| SCHEMBL7521076 | 0.82 | MDM4 (0.54) | HPGDPOLBCYP2C19NPC1RAB9A | |
| SCHEMBL13846445 | 0.82 | MAPT (0.59) | ALDH1A1HPGDPOLBCYP2C19NAPRT | |
| SCHEMBL7780927 | 0.78 | RXFP1 (0.51) | ALDH1A1HPGDPOLBCYP2C19MAPK1 | |
| SCHEMBL13846447 | 0.78 | MAPT (0.54) | ALDH1A1HPGDPOLBCYP2C19HSD17B10 | |
| SCHEMBL6689158 | 0.77 | ALDH1A1 (0.74) | ALDH1A1HPGDPOLBCYP2C19NAPRT | |
| SCHEMBL18729658 | 0.76 | TDP1 (0.46) | ALDH1A1HPGDPOLBHSD17B10SMN1; SMN2 | |
| SCHEMBL2044796 | 0.76 | TDP1 (0.50) | ALDH1A1HPGDCYP2C19HSD17B10MAPK1 | |
| SCHEMBL13846438 | 0.75 | NFE2L2 (0.41) | ALDH1A1HPGDPOLBCYP2C19HSD17B10 | |
| SCHEMBL728079 | 0.74 | ALDH1A1 (0.63) | ALDH1A1HPGDPOLBCYP2C19NAPRT |
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 |
|---|---|---|---|---|---|---|---|
| CN-117700456-A | Arylamine photocatalyst and preparation method thereof, defluorinated mono-bridged ring propeller compound, preparation method and application thereof | 国科大杭州高等研究院 | 2024-03-15 | — | — | CN | claimed |
| CN-117700456-A | Arylamine photocatalyst and preparation method thereof, defluorinated mono-bridged ring propeller compound, preparation method and application thereof | 国科大杭州高等研究院 | 2024-03-15 | — | — | CN | disclosed |