Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.82 |
| ▸ | TSHR | P16473 | 4/20 | 0.82 |
| ▸ | LMNA | P02545 | 2/20 | 0.82 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.79 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.79 |
| ▸ | TP53 | P04637 | 1/20 | 0.79 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.71 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.71 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.67 |
| ▸ | POLB | P06746 | 1/20 | 0.67 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.52 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.52 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.52 |
| ▸ | FAAH | O00519 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL10338878 | 1.00 | ALDH1A1 (0.82) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL18694612 | 1.00 | ALDH1A1 (0.82) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL10338877 | 1.00 | ALDH1A1 (0.82) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL10338880 | 1.00 | ALDH1A1 (0.82) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL10338875 | 1.00 | ALDH1A1 (0.82) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL8159950 | 1.00 | ALDH1A1 (0.82) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| Olealdehyde SCHEMBL6729579 | 0.96 | ALDH1A1 (0.75) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| Olealdehyde SCHEMBL6736085 | 0.96 | ALDH1A1 (0.75) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL8159956 | 0.94 | ALDH1A1 (0.73) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL538987 | 0.94 | ALDH1A1 (0.73) | 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 |
|---|---|---|---|---|---|---|---|
| US-10131861-B2 | Corrosion-inhibiting compositions | CLARIANT INTERNATIONAL LTD. (CH) | 2018-11-20 | — | — | US | disclosed |
| US-20170218293-A1 | Corrosion-Inhibiting Compositions | CLARIANT INTERNATIONAL LTD. (CH) | 2017-08-03 | — | — | US | disclosed |
| US-20170101606-A1 | Use Of N-Methyl-N-Acylglucamine As Corrosion Inhibitor | CLARIANT INTERNATIONAL LTD. (CH) | 2017-04-13 | — | — | US | disclosed |