Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 6/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.73 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.73 |
| ▸ | TP53 | P04637 | 3/20 | 0.73 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.58 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | APP | P05067 | 3/20 | 0.48 |
| ▸ | KIF11 | P52732 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Benzidine SCHEMBL28721485 | 0.97 | TDP1 (0.69) | TDP1ALDH1A1CYP3A4TP53HSD17B10 | |
| Benzidine SCHEMBL27459735 | 0.86 | ALDH1A1 (0.85) | TDP1ALDH1A1CYP3A4TP53HSD17B10 | |
| Benzidine SCHEMBL501952 | 0.86 | ALDH1A1 (0.85) | TDP1ALDH1A1CYP3A4TP53HSD17B10 | |
| Benzidine SCHEMBL720393 | 0.86 | CYP3A4 (1.00) | TDP1ALDH1A1CYP3A4TP53HSD17B10 | |
| Benzidine SCHEMBL29021 | 0.86 | CYP3A4 (1.00) | TDP1ALDH1A1CYP3A4TP53HSD17B10 | |
| SCHEMBL28842081 | 0.86 | CYP3A4 (1.00) | TDP1ALDH1A1CYP3A4TP53HSD17B10 | |
| SCHEMBL2024128 | 0.86 | CYP3A4 (1.00) | TDP1ALDH1A1CYP3A4TP53HSD17B10 | |
| SCHEMBL258287 | 0.86 | CYP3A4 (1.00) | TDP1ALDH1A1CYP3A4TP53HSD17B10 | |
| Benzidine SCHEMBL5140469 | 0.86 | CYP3A4 (1.00) | TDP1ALDH1A1CYP3A4TP53HSD17B10 | |
| SCHEMBL1926936 | 0.83 | TDP1 (0.84) | TDP1ALDH1A1CYP3A4TP53HSD17B10 |
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-109971151-B | Bisphthalonitrile resin fiber reinforced material containing triaryl s-triazine structure and preparation method thereof | 大连理工大学 | 2021-09-17 | — | — | CN | disclosed |
| CN-113147105-A | Porous polyimide oil storage and retention structure and preparation method and application thereof | 中国科学院兰州化学物理研究所 | 2021-07-23 | — | — | CN | disclosed |