Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 7/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | MMP8 | P22894 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.46 |
| ▸ | PRNP | P04156 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | SLC1A5 | Q15758 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL27623428 | 0.88 | PIN1 (0.46) | PIN1NPC1MEN1KMT2AALDH1A1 | |
| Phenol SCHEMBL27676796 | 0.87 | PIN1 (0.49) | PIN1NPC1MEN1KMT2AMAPT | |
| SCHEMBL27853342 | 0.87 | SLC1A3 (0.48) | PIN1NPC1MEN1KMT2AMAPT | |
| Benzene SCHEMBL28141968 | 0.86 | PIN1 (0.48) | PIN1NPC1MEN1KMT2AALDH1A1 | |
| SCHEMBL196408 | 0.82 | — | — | |
| SCHEMBL135308 | 0.82 | — | — | |
| SCHEMBL5407602 | 0.82 | TSHR (0.50) | PIN1NPC1MEN1KMT2AMAPT | |
| SCHEMBL5405829 | 0.82 | TSHR (0.50) | PIN1NPC1MEN1KMT2AMAPT | |
| SCHEMBL372610 | 0.82 | — | — | |
| Biphenyl SCHEMBL5927309 | 0.81 | TAAR1 (0.56) | KMT2ATAAR1MAPTALDH1A1HSD17B10 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105330569-A | Preparation method of (R)-2-(N-tertbutyloxycarbonylamino)biphenylpropanol | TONGJING OPTOELECTRONICS TECHNOLOGY CO LTD | 2016-02-17 | — | — | CN | disclosed |