Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPA1 | P27694 | 1/20 | 0.49 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | RORC | P51449 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | STAT1 | P42224 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.39 |
| ▸ | TUBB | P07437 | 1/20 | 0.39 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.39 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.39 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16516480 | 0.89 | ELANE (0.47) | RPA1MAP3K14KMT2AALDH1A1MAPT | |
| SCHEMBL16516840 | 0.78 | RPA1 (0.56) | RPA1MAP3K14KMT2AALDH1A1PKM | |
| SCHEMBL16517765 | 0.78 | RPA1 (0.56) | RPA1MAP3K14KMT2AALDH1A1PKM | |
| SCHEMBL16517137 | 0.77 | STAT1 (0.49) | RPA1MAP3K14ALDH1A1RORCSTAT1 | |
| SCHEMBL16516950 | 0.77 | RPA1 (0.47) | RPA1MAP3K14KMT2AALDH1A1STAT1 | |
| SCHEMBL16517541 | 0.77 | RPA1 (0.47) | RPA1MAP3K14KMT2AALDH1A1STAT1 | |
| SCHEMBL16516970 | 0.76 | MAP3K14 (0.47) | RPA1MAP3K14KMT2AALDH1A1MEN1 | |
| SCHEMBL16516420 | 0.76 | MAP3K14 (0.43) | RPA1MAP3K14ALDH1A1RORCPKM | |
| SCHEMBL16517055 | 0.76 | SCN9A (0.44) | RPA1MAP3K14ALDH1A1RORCSTAT1 | |
| SCHEMBL7354285 | 0.75 | HTR3A (0.55) | KMT2AALDH1A1MEN1RORCPKM |
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 |
|---|---|---|---|---|---|---|---|
| EP-3036230-A1 | ALKYNYL ALCOHOLS AND METHODS OF USE | F. Hoffmann-La Roche AG (CH) | 2016-06-29 | — | — | EP | disclosed |
| WO-2015025025-A1 | ALKYNYL ALCOHOLS AND METHODS OF USE | F. HOFFMANN-LA ROCHE AG (CH) | 2015-02-26 | — | — | WO | disclosed |