Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | POLB | P06746 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | GABRP | O00591 | 1/20 | 0.30 |
| ▸ | GABRD | O14764 | 1/20 | 0.30 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.30 |
| ▸ | GABRB1 | P18505 | 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 | |
|---|---|---|---|---|
| SCHEMBL8468779 | 0.78 | HTT (0.33) | ALDH1A1HPGDSMN1; SMN2LMNATP53 | |
| SCHEMBL10364596 | 0.70 | NPC1 (0.51) | ALDH1A1MEN1KMT2APOLBMAPT | |
| SCHEMBL11162218 | 0.69 | ALDH1A1 (0.50) | ALDH1A1HSD17B10TSHRCYP3A4KDM4E | |
| SCHEMBL10569056 | 0.69 | ALDH1A1 (0.54) | ALDH1A1HSD17B10TSHRCYP3A4KDM4E | |
| SCHEMBL19952852 | 0.67 | IMPDH2 (0.41) | ALDH1A1TSHRCYP3A4MEN1KMT2A | |
| SCHEMBL30057902 | 0.67 | CYP3A4 (0.47) | ALDH1A1HSD17B10TSHRCYP3A4KDM4E | |
| SCHEMBL8545431 | 0.66 | MAPT (0.43) | ALDH1A1HSD17B10TSHRCYP3A4HPGD | |
| SCHEMBL6356465 | 0.66 | CYP3A4 (0.36) | ALDH1A1HSD17B10TSHRCYP3A4KDM4E | |
| SCHEMBL8543921 | 0.66 | ALDH1A1 (0.43) | ALDH1A1HSD17B10TSHRCYP3A4KDM4E | |
| SCHEMBL11077537 | 0.66 | MAPT (0.45) | ALDH1A1TSHRCYP3A4LMNAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-57109752-A | — | — | None | — | — | JP | disclosed |
| JP-S57109752-A | NOVEL 4-AMINO-2,6-DIALKYL-3-NITROBENZOIC ACID ALKYL ESTER DERIVATIVE | ISHIKAWA MASAYUKI | 1982-07-08 | — | — | JP | disclosed |