Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.64 |
| ▸ | TSHR | P16473 | 4/20 | 0.64 |
| ▸ | LMNA | P02545 | 2/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | KDM4A | O75164 | 1/20 | 0.49 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7064777 | 1.00 | ALDH1A1 (0.64) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL28846625 | 0.91 | ALDH1A1 (0.69) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL10883059 | 0.88 | ALDH1A1 (0.64) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL10884836 | 0.88 | ALDH1A1 (0.64) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL11147509 | 0.88 | TSHR (0.47) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL10886287 | 0.88 | ALDH1A1 (0.64) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL27652011 | 0.87 | ALDH1A1 (0.77) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL27604952 | 0.86 | TSHR (0.62) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL8950948 | 0.86 | TSHR (0.46) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL10886999 | 0.86 | TSHR (0.63) | ALDH1A1TSHRLMNACYP3A4MAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021202876-A1 | POLYURETHANE PREPOLYMER COMPOSITION COMPRISING AN ALKYL BENZOATE | LANXESS CORPORATION (US) | 2021-10-07 | — | — | WO | disclosed |
| EP-2155654-A1 | IMPROVEMENT IN ESTER PRODUCTION | ExxonMobil Chemical Patents Inc. (US) | 2010-02-24 | — | — | EP | disclosed |
| WO-2008110304-A1 | IMPROVEMENT IN ESTER PRODUCTION | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2008-09-18 | — | — | WO | disclosed |