Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 2/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15560653 | 0.94 | ALDH1A1 (0.43) | ALDH1A1HPGDSMN1; SMN2MEN1KMT2A | |
| SCHEMBL15553626 | 0.91 | ALDH1A1 (0.45) | ALDH1A1HPGDSMN1; SMN2MEN1KMT2A | |
| SCHEMBL15554810 | 0.88 | ALDH1A1 (0.42) | ALDH1A1HPGDSMN1; SMN2MEN1KMT2A | |
| SCHEMBL15561001 | 0.88 | ALDH1A1 (0.42) | ALDH1A1HPGDSMN1; SMN2TSHRMAPK1 | |
| SCHEMBL15553721 | 0.88 | ALDH1A1 (0.42) | ALDH1A1HPGDSMN1; SMN2TSHRMAPK1 | |
| SCHEMBL15555341 | 0.87 | ALDH1A1 (0.43) | ALDH1A1HPGDSMN1; SMN2MEN1KMT2A | |
| SCHEMBL15554838 | 0.87 | ALDH1A1 (0.43) | ALDH1A1HPGDSMN1; SMN2MEN1KMT2A | |
| SCHEMBL15554641 | 0.87 | ALDH1A1 (0.43) | ALDH1A1HPGDSMN1; SMN2TSHRMAPK1 | |
| SCHEMBL15553897 | 0.87 | ALDH1A1 (0.42) | ALDH1A1HPGDSMN1; SMN2TSHRMAPK1 | |
| SCHEMBL15554759 | 0.87 | P2RX7 (0.40) | ALDH1A1HPGDSMN1; SMN2MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014002110-A1 | SUBSTITUTUED PYRAZOLE COMPOUNDS AND PROCESS FOR PREPARATION THEREOF. | RALLIS INDIA LIMITED (IN) | 2014-01-03 | — | — | WO | claimed |
| WO-2014002110-A1 | SUBSTITUTUED PYRAZOLE COMPOUNDS AND PROCESS FOR PREPARATION THEREOF. | RALLIS INDIA LIMITED (IN) | 2014-01-03 | — | — | WO | disclosed |