Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.39 |
| ▸ | APP | P05067 | 1/20 | 0.39 |
| ▸ | TYMS | P04818 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | EGFR | P00533 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.34 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12320515 | 0.79 | TYMS (0.44) | NQO2MTNR1AMTNR1BTYMSMAPT | |
| SCHEMBL6971804 | 0.74 | ALDH1A1 (0.52) | APPKDM1AMAPTALDH1A1TSHR | |
| SCHEMBL25761244 | 0.74 | CYP2A6 (0.47) | APPTYMSMAPTALDH1A1EGFR | |
| SCHEMBL16194520 | 0.74 | ALDH1A1 (0.56) | KDM1AMAPTALDH1A1KDM4EHPGD | |
| SCHEMBL28101043 | 0.72 | CYP3A4 (0.45) | MTNR1AMTNR1BAPPMAPTALDH1A1 | |
| SCHEMBL3954151 | 0.72 | TYMS (0.40) | NQO2MTNR1AMTNR1BTYMSMAPT | |
| SCHEMBL2317686 | 0.71 | MAPT (0.56) | MAPTALDH1A1GAAHPGDTSHR | |
| SCHEMBL8637909 | 0.71 | AKR1C3 (0.52) | NQO2MTNR1AMTNR1BTYMSMAPT | |
| SCHEMBL29740644 | 0.71 | AKR1C3 (0.52) | NQO2MTNR1AMTNR1BTYMSMAPT | |
| SCHEMBL16194452 | 0.71 | HPRT1 (0.56) | KDM1AMAPTALDH1A1HPGDTSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020225778-A1 | MATERIALS FOR FORMING A NUCLEATION-INHIBITING COATING AND DEVICES INCORPORATING SAME | OTI LUMIONICS INC. (CA) | 2020-11-12 | — | — | WO | disclosed |