Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 1/20 | 0.47 |
| ▸ | QPCT | Q16769 | 11/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 5/20 | 0.42 |
| ▸ | RAB9A | P51151 | 5/20 | 0.42 |
| ▸ | HTT | P42858 | 4/20 | 0.42 |
| ▸ | GALR3 | O60755 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9773448 | 1.00 | TBXAS1 (0.47) | TBXAS1QPCTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL16321117 | 1.00 | TBXAS1 (0.47) | TBXAS1QPCTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9625488 | 1.00 | TBXAS1 (0.47) | TBXAS1QPCTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL19286072 | 1.00 | TBXAS1 (0.47) | TBXAS1QPCTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9625860 | 1.00 | TBXAS1 (0.47) | TBXAS1QPCTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL1766186 | 1.00 | TBXAS1 (0.47) | TBXAS1QPCTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL2945045 | 1.00 | TBXAS1 (0.47) | TBXAS1QPCTCYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL9626085 | 0.98 | TBXAS1 (0.46) | TBXAS1QPCTCYP1A2CYP3A4CYP2D6 | |
| Bromide SCHEMBL10325056 | 0.98 | TBXAS1 (0.46) | TBXAS1QPCTCYP1A2CYP3A4CYP2D6 | |
| Iodide SCHEMBL10324529 | 0.98 | TBXAS1 (0.46) | TBXAS1QPCTCYP1A2CYP3A4CYP2D6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5112844-A | Micelles | MEDICE CHEM.-PHARM. FABRIK PUTTER GMBH & CO. KG (DE) | 1992-05-12 | — | — | US | disclosed |
| US-5051435-A | Micelles of triazolium compounds as cationic surfactants | MEDICE CHEM.-PHARM. FABRIK PUTTER GMBH & CO. KG (DE) | 1991-09-24 | — | — | US | disclosed |
| US-4882435-A | CATIONIC TENSIDES; THIADIAZOLIUM SALTS | MEDICE CHEM.-PHARM. FABRIK (DE) | 1989-11-21 | — | — | US | disclosed |
| US-4877883-A | CATIONIC SURFACTANTS | MEDICE CHEM.-PHARM. FABRIK PUTTER GMBH & CO. KG (DE) | 1989-10-31 | — | — | US | disclosed |