Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | LONP1 | P36776 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL9720328 | 0.99 | LMNA (0.38) | LMNACYP19A1KDM4EHTTGAA | |
| SCHEMBL9720347 | 0.86 | CYP19A1 (0.35) | LMNACYP19A1KDM4EHTTGAA | |
| SCHEMBL11068158 | 0.85 | SMN1; SMN2 (0.37) | LMNACYP19A1KDM4EHTTRAB9A | |
| SCHEMBL9720309 | 0.77 | CYP3A4 (0.43) | LMNACYP19A1KDM4ERAB9AKMT2A | |
| SCHEMBL9720368 | 0.77 | DPP8 (0.36) | RAB9AKMT2APOLBNPC1ALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL9720294 | 0.76 | CYP3A4 (0.43) | LMNACYP19A1KDM4ERAB9AKMT2A | |
| SCHEMBL9720359 | 0.75 | KIF11 (0.37) | LMNACYP19A1HTTGAASMN1; SMN2 | |
| Ammonia Solution, Strong SCHEMBL9720345 | 0.74 | KIF11 (0.36) | LMNACYP19A1HTTGAASMN1; SMN2 | |
| SCHEMBL781413 | 0.73 | CYP19A1 (0.43) | LMNACYP19A1KDM4ERAB9ALONP1 | |
| SCHEMBL781412 | 0.73 | CYP19A1 (0.43) | LMNACYP19A1KDM4ERAB9ALONP1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5148817-A | Heterocyclic hydroxy-substituted carboxylic compound as flavor additive | PHILIP MORRIS INCORPORATED (US) | 1992-09-22 | — | — | US | claimed |
| EP-0052969-A2 | Flavorant compounds, their pyrolysis products, and smoking and food compositions containing them | PHILIP MORRIS INCORPORATED (US) | 1982-06-02 | — | — | EP | claimed |
| US-5148817-A | Heterocyclic hydroxy-substituted carboxylic compound as flavor additive | PHILIP MORRIS INCORPORATED (US) | 1992-09-22 | — | — | US | disclosed |
| US-4592373-A | Smoking compositions | PHILIP MORRIS INC. (US) | 1986-06-03 | — | — | US | disclosed |
| EP-0052969-A2 | Flavorant compounds, their pyrolysis products, and smoking and food compositions containing them | PHILIP MORRIS INCORPORATED (US) | 1982-06-02 | — | — | EP | disclosed |