Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.55 |
| ▸ | CES1 | P23141 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.42 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28662743 | 0.92 | TSHR (0.55) | CES2CES1TSHRLOXL2CYP4F2 | |
| SCHEMBL6932503 | 0.88 | HDAC8 (0.56) | CES2CES1RXFP1HDAC8HDAC6 | |
| SCHEMBL9432396 | 0.88 | CA12 (0.53) | CES2CES1PARP1NPC1RAB9A | |
| SCHEMBL31135462 | 0.86 | CES2 (0.79) | CES2CES1TSHRRXFP1PARP1 | |
| SCHEMBL4737739 | 0.86 | CES2 (0.79) | CES2CES1TSHRRXFP1PARP1 | |
| SCHEMBL6589547 | 0.86 | CES2 (0.68) | CES2CES1HDAC6PARP1NPC1 | |
| SCHEMBL1525400 | 0.86 | PARP1 (0.53) | CES2CES1L3MBTL1PARP1NPC1 | |
| SCHEMBL2878179 | 0.86 | PARP1 (0.53) | CES2CES1PARP1NPC1RAB9A | |
| SCHEMBL14013691 | 0.85 | KMO (0.56) | TSHRHDAC8TDP1GAAKMT2A | |
| SCHEMBL28101906 | 0.84 | TSHR (0.56) | CES2CES1TSHRNPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-6254950-B1 | BLEND WITH POLYETHYLENE TEREPHTHALATE AND NAPHTHALATE, POLYBUTYLENE AND POLYTRIMETHYLENE TEREPHTHALATE, AND/OR POLYBUTYLENE NAPHTHALATE; PACKAGING | EASTMAN CHEMICAL COMPANY | 2001-07-03 | — | — | US | disclosed |