Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.57 |
| ▸ | TSHR | P16473 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | RGS12 | O14924 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
| ▸ | APEX1 | P27695 | 1/20 | 0.53 |
| ▸ | THPO | P40225 | 1/20 | 0.53 |
| ▸ | BLM | P54132 | 1/20 | 0.53 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.53 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL283587 | 0.98 | CA2 (0.71) | CA2KDM4ETSHRMAPTHPGD | |
| Hydrochloric Acid SCHEMBL2530252 | 0.96 | CA2 (0.69) | CA2KDM4ETSHRMAPTHPGD | |
| Methyl Alcohol SCHEMBL7045180 | 0.94 | CA2 (0.67) | CA2KDM4ETSHRMAPTHPGD | |
| SCHEMBL11361475 | 0.86 | HAO1 (0.58) | CA2KDM4ETSHRMAPTHPGD | |
| SCHEMBL377506 | 0.82 | CA2 (1.00) | CA2KDM4ETSHRMAPTHPGD | |
| SCHEMBL11859884 | 0.82 | CA2 (0.67) | CA2KDM4ETSHRMAPTHPGD | |
| SCHEMBL585295 | 0.82 | CA2 (0.72) | CA2KDM4ETSHRMAPTHPGD | |
| SCHEMBL2164422 | 0.82 | HAO1 (0.57) | CA2KDM4ETSHRBLMPIK3CA | |
| SCHEMBL659220 | 0.81 | PIK3CA (0.54) | CA2TSHRPIK3CAKMT2AIDO1 | |
| SCHEMBL1245996 | 0.80 | CA2 (0.59) | CA2KDM4ETSHRMAPTHPGD |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6271395-B1 | E.G.,(.+-.)-N-(2,3-DIHYDRO-2-(1-PYRROLIDINYL)-1H-INDEN-1-Y1) -2 ,4-DINITRO-N-METHYL-BENZENE-ACETAMIDE; STRONG AFFINITY FOR OPTICAL RECEPTORS, CENTRAL ANALGESIC, DIURETIC, ANTIARRYTHMIC, HYPOTENSIVE AND ANTIISCHEMIC ACTIVITY. | HOECHST MARION ROUSSOL (FR) | 2001-08-07 | — | — | US | disclosed |
| US-5234944-A | Analgesic for mammals | ROUSSEL UCLAF (FR) | 1993-08-10 | — | — | US | disclosed |
| US-5043347-A | Indanes and analgesic compositions and methods thereof | ROUSSEL UCLAF (FR) | 1991-08-27 | — | — | US | disclosed |
| US-4988810-A | Chemical intermediates for central nervous system analgesics and antiarrhythmia agents | ROUSSEL UCLAF (FR) | 1991-01-29 | — | — | US | disclosed |
| US-4968700-A | DIURETIC, HYPOTENSIVE, ANTIISCHEMIC, ANTIARRHYTHMIA | ROUSSEL UCLAF (FR) | 1990-11-06 | — | — | US | disclosed |
| US-4816465-A | Decahydroquinolines and analgesic use thereof | ROUSSEL UCLAF (FR) | 1989-03-28 | — | — | US | disclosed |