Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.40 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 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 | |
|---|---|---|---|---|
| SCHEMBL17892405 | 0.93 | CA12 (0.46) | TDP1HSD17B10L3MBTL1ALDH1A1KMT2A | |
| Isophthalic Acid SCHEMBL9008990 | 0.93 | CA12 (0.46) | TDP1HSD17B10L3MBTL1ALDH1A1KMT2A | |
| SCHEMBL9008994 | 0.93 | CA12 (0.46) | TDP1HSD17B10L3MBTL1ALDH1A1KMT2A | |
| SCHEMBL8925349 | 0.87 | PARP1 (0.50) | TDP1L3MBTL1ALDH1A1KMT2ARAB9A | |
| SCHEMBL140863 | 0.85 | TSHR (0.56) | TDP1HSD17B10ATMTSHRALDH1A1 | |
| SCHEMBL123941 | 0.83 | TDP1 (0.44) | TDP1LOXL2ATML3MBTL1CYP4F2 | |
| SCHEMBL5450979 | 0.82 | TDP1 (0.48) | TDP1HSD17B10LOXL2TSHRALDH1A1 | |
| SCHEMBL10791915 | 0.80 | KDM4E (0.41) | TDP1HSD17B10ATMTSHRALDH1A1 | |
| SCHEMBL3965774 | 0.79 | CA12 (0.61) | HSD17B10L3MBTL1ALDH1A1KMT2APOLB | |
| SCHEMBL4597257 | 0.78 | ELANE (0.44) | TDP1HSD17B10KMT2APOLB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016106624-A1 | TERTIARY ALCOHOL IMIDAZOPYRAZINE BTK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2016-07-07 | — | — | WO | disclosed |
| WO-2016106623-A1 | BENZAMIDE IMIDAZOPYRAZINE BTK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2016-07-07 | — | — | WO | disclosed |
| US-5534614-A | Method for the preparation of amide oligomers and polybenzazole polymers therefrom | THE DOW CHEMICAL COMPANY (US) | 1996-07-09 | — | — | US | disclosed |
| US-5322916-A | Method for the preparation of amide oligomers and polybenzazole polymers therefrom | THE DOW CHEMICAL COMPANY (US) | 1994-06-21 | — | — | US | disclosed |