Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.60 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.60 |
| ▸ | TSHR | P16473 | 4/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1616513 | 0.82 | ALDH1A1 (0.69) | ALDH1A1TDP1TSHRTP53SMN1; SMN2 | |
| SCHEMBL1982757 | 0.79 | TLR8 (0.45) | ALDH1A1TDP1TSHRHPGDMEN1 | |
| SCHEMBL19622615 | 0.79 | GPR35 (0.53) | ALDH1A1TDP1TSHRTP53HPGD | |
| SCHEMBL19398525 | 0.77 | ALDH1A1 (0.62) | ALDH1A1TDP1TSHRTP53SMN1; SMN2 | |
| SCHEMBL17693438 | 0.77 | TSHR (0.45) | ALDH1A1TDP1TSHRHPGDPOLB | |
| SCHEMBL635089 | 0.77 | ALDH1A1 (1.00) | ALDH1A1TDP1TSHRSMN1; SMN2HPGD | |
| SCHEMBL12353505 | 0.76 | ALDH1A1 (0.60) | ALDH1A1TDP1TSHRTP53SMN1; SMN2 | |
| SCHEMBL18365033 | 0.76 | TDP1 (0.60) | ALDH1A1TDP1TSHRSMN1; SMN2HPGD | |
| SCHEMBL11233959 | 0.76 | ALDH1A1 (0.60) | ALDH1A1TDP1TSHRTP53SMN1; SMN2 | |
| SCHEMBL10314059 | 0.76 | TSHR (0.38) | ALDH1A1TDP1TSHRSMN1; SMN2HPGD |
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-108129322-A | A kind of synthetic method of 2- nitros -3- methyl benzoic acids | 江西科苑生物药业有限公司 | 2018-06-08 | — | — | CN | claimed |
| CN-110156751-A | A kind of new method preparing Ni Lapani and its intermediate | 江苏食品药品职业技术学院 | 2019-08-23 | — | — | CN | disclosed |