Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 5/20 | 0.63 |
| ▸ | CES1 | P23141 | 5/20 | 0.63 |
| ▸ | LMNA | P02545 | 3/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17894698 | 0.94 | CES2 (0.63) | CES2CES1LMNAALDH1A1TSHR | |
| SCHEMBL6758776 | 0.87 | ALDH1A1 (0.68) | CES2CES1LMNAALDH1A1TSHR | |
| SCHEMBL5445265 | 0.87 | CES2 (0.83) | CES2CES1LMNAALDH1A1TSHR | |
| SCHEMBL4331474 | 0.80 | ALDH1A1 (0.68) | CES2CES1LMNAALDH1A1TSHR | |
| Benzoin SCHEMBL2961461 | 0.79 | CES2 (0.70) | CES2CES1LMNAALDH1A1KDM4E | |
| Benzoin SCHEMBL4557692 | 0.79 | LMNA (0.91) | CES2CES1LMNAALDH1A1HSD17B10 | |
| Benzoin SCHEMBL145 | 0.78 | CES2 (1.00) | CES2CES1LMNAALDH1A1TSHR | |
| Benzoin SCHEMBL901258 | 0.78 | CES2 (1.00) | CES2CES1LMNAALDH1A1TSHR | |
| Benzoin SCHEMBL2025536 | 0.78 | CES2 (1.00) | CES2CES1LMNAALDH1A1TSHR | |
| Benzoin SCHEMBL10665271 | 0.78 | CES2 (1.00) | CES2CES1LMNAALDH1A1TSHR |
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-3240791-A1 | PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS | Forma Therapeutics, Inc. (US) | 2017-11-08 | — | — | EP | disclosed |
| WO-2016109515-A1 | PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS | FORMA THERAPEUTICS, INC. (US) | 2016-07-07 | — | — | WO | disclosed |