Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NMT1 | P30419 | 1/20 | 0.46 |
| ▸ | AHR | P35869 | 4/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | PLAU | P00749 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.30 |
| ▸ | APEX1 | P27695 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28667897 | 0.84 | TDP1 (0.41) | NMT1AHRCYP3A4TSHRTDP1 | |
| SCHEMBL12449520 | 0.80 | ALDH1A1 (0.38) | NMT1TSHRMEN1MAPTKMT2A | |
| SCHEMBL13550074 | 0.80 | NMT1 (0.38) | NMT1CYP3A4GABRA1GABRB1MEN1 | |
| SCHEMBL793988 | 0.80 | NMT1 (0.38) | NMT1TDP1MEN1MAPTKMT2A | |
| SCHEMBL10616362 | 0.79 | TTR (0.47) | AHRCYP3A4TSHRGAAMAPK1 | |
| SCHEMBL450499 | 0.79 | ALDH1A1 (0.53) | AHRCYP3A4TSHRMEN1MAPT | |
| SCHEMBL10872330 | 0.79 | ALDH1A1 (0.53) | NMT1AHRCYP3A4TSHRTDP1 | |
| SCHEMBL1751110 | 0.76 | NMT1 (0.50) | NMT1AHRCYP3A4TSHRTDP1 | |
| SCHEMBL5354779 | 0.76 | NMT1 (0.44) | NMT1AHRCYP3A4TSHRTDP1 | |
| Boric Acid SCHEMBL2462494 | 0.76 | CYP3A4 (0.40) | NMT1AHRCYP3A4TSHRTDP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116891399-A | Preparation method of 2, 5-dibromo-1, 3-dichlorobenzene | 清源创新实验室 | 2023-10-17 | — | — | CN | claimed |
| CN-116891399-A | Preparation method of 2, 5-dibromo-1, 3-dichlorobenzene | 清源创新实验室 | 2023-10-17 | — | — | CN | disclosed |
| CN-116891399-A | Preparation method of 2, 5-dibromo-1, 3-dichlorobenzene | 清源创新实验室 | 2023-10-17 | — | — | CN | disclosed |
| CN-116891399-A | Preparation method of 2, 5-dibromo-1, 3-dichlorobenzene | 清源创新实验室 | 2023-10-17 | — | — | CN | disclosed |