Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 1/20 | 0.68 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.61 |
| ▸ | MAPT | P10636 | 2/20 | 0.61 |
| ▸ | GAA | P10253 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.55 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.55 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
| ▸ | FAAH | O00519 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7554369 | 0.85 | ITGB1 (0.66) | ITGB1ITGA4ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL7553920 | 0.82 | ITGB1 (0.58) | ITGB1ITGA4ALDH1A1MAPTGAA | |
| SCHEMBL7555562 | 0.82 | MAPT (0.62) | ITGB1ITGA4MAPTTAS1R3TAS1R1 | |
| SCHEMBL11143676 | 0.78 | TAS1R3 (0.73) | ALDH1A1MAPTGAASMN1; SMN2TAS1R3 | |
| SCHEMBL7552286 | 0.76 | ALDH1A1 (0.56) | ITGB1ITGA4ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL4868401 | 0.75 | THRB (0.59) | MAPTGAASMN1; SMN2TAS1R3TAS1R1 | |
| SCHEMBL7556321 | 0.73 | MAPT (0.63) | ITGB1ITGA4ALDH1A1MAPTGAA | |
| Hydrochloric Acid SCHEMBL10840615 | 0.73 | GAA (0.50) | ALDH1A1MAPTGAASMN1; SMN2TAS1R3 | |
| SCHEMBL29077464 | 0.72 | TAS1R3 (0.81) | ALDH1A1GAASMN1; SMN2TAS1R3TAS1R1 | |
| SCHEMBL704779 | 0.71 | TAS1R3 (1.00) | ALDH1A1MAPTSMN1; SMN2TAS1R3TAS1R1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2002055661-A2 | FATTY ACID SYNTHASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2002-07-18 | — | — | WO | claimed |
| WO-2002055661-A2 | FATTY ACID SYNTHASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2002-07-18 | — | — | WO | disclosed |