Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | GMNN | O75496 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 6/20 | 0.34 |
| ▸ | CA1 | P00915 | 6/20 | 0.34 |
| ▸ | CA2 | P00918 | 6/20 | 0.34 |
| ▸ | CA9 | Q16790 | 6/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL3074808 | 0.97 | — | — | |
| SCHEMBL10897991 | 0.94 | HTT (0.42) | ALDH1A1MAPTHPGDHTTCA12 | |
| SCHEMBL3071699 | 0.94 | HTT (0.42) | ALDH1A1MAPTHPGDHTTCA12 | |
| Ammonia Solution, Strong SCHEMBL28405557 | 0.93 | HTT (0.34) | ALDH1A1MAPTHPGDHTTGMNN | |
| SCHEMBL28146447 | 0.92 | HTT (0.41) | ALDH1A1MAPTHPGDHTTCA12 | |
| SCHEMBL3066005 | 0.90 | HTT (0.35) | ALDH1A1MAPTHPGDHTTCA12 | |
| SCHEMBL7758216 | 0.87 | HTT (0.34) | HTTCA12CA1CA2CA9 | |
| SCHEMBL3074878 | 0.87 | HTT (0.38) | ALDH1A1HTTCA12CA1CA2 | |
| SCHEMBL6515029 | 0.85 | HTT (0.37) | ALDH1A1HTTCA12CA1CA2 | |
| Pyrrolidine SCHEMBL11631842 | 0.84 | ALDH1A1 (0.33) | ALDH1A1HTTCA2 |
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-2008113814-A1 | ORGANIC MOLYBDENUM COMPOUNDS, USE THEREOF AS FRICTION- MODIFIERS AND LUBRICATING COMPOSITIONS | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2008-09-25 | — | — | WO | disclosed |