Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TMEM97 | Q5BJF2 | 3/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | CCR1 | P32246 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | SLC6A12 | P48065 | 2/20 | 0.53 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL61320 | 0.87 | TMEM97 (0.68) | TMEM97SIGMAR1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL3664764 | 0.77 | CHRM2 (0.55) | TMEM97SIGMAR1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL61848 | 0.77 | TMEM97 (0.83) | TMEM97SIGMAR1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4441011 | 0.76 | SLC6A5 (0.55) | TMEM97SIGMAR1CYP1A2CYP3A4CYP2D6 | |
| Bicarbonate SCHEMBL9236554 | 0.75 | TMEM97 (0.76) | TMEM97SIGMAR1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4441461 | 0.74 | KMT2A (0.64) | TMEM97SIGMAR1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4429895 | 0.73 | UTS2R (0.65) | SIGMAR1CYP2D6KMT2AMCHR1MEN1 | |
| SCHEMBL694949 | 0.72 | SIGMAR1 (0.82) | TMEM97SIGMAR1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL3366478 | 0.72 | SIGMAR1 (1.00) | TMEM97SIGMAR1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4435309 | 0.71 | POLB (0.61) | TMEM97SIGMAR1CYP2D6KMT2ASLC6A12 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2231666-A1 | CARBOXAMIDE, SULFONAMIDE AND AMINE COMPOUNDS FOR METABOLIC DISORDERS | Rigel Pharmaceuticals, Inc. (US) | 2010-09-29 | — | — | EP | claimed |
| WO-2009076631-A1 | CARBOXAMIDE, SULFONAMIDE AND AMINE COMPOUNDS FOR METABOLIC DISORDERS | RIGEL PHARMACEUTICALS, INC. (US) | 2009-06-18 | — | — | WO | claimed |