Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MIF | P14174 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | KIF11 | P52732 | 6/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.39 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.39 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11618600 | 0.90 | MIF (0.67) | MIFCYP2C19HIF1ACYP1A2KIF11 | |
| SCHEMBL11613454 | 0.84 | KCNA5 (0.47) | CYP2C19HIF1ACYP1A2KCNH2ALDH1A1 | |
| SCHEMBL503257 | 0.81 | MIF (0.65) | MIFCYP2C19HIF1ACYP1A2KIF11 | |
| SCHEMBL11611822 | 0.80 | KIF11 (0.45) | MIFCYP2C19HIF1ACYP1A2KIF11 | |
| SCHEMBL20546665 | 0.79 | MIF (0.63) | MIFCYP2C19HIF1ACYP1A2KIF11 | |
| SCHEMBL9474959 | 0.78 | CYP2C19 (0.53) | CYP2C19HIF1ACYP1A2KIF11MAPT | |
| SCHEMBL27485981 | 0.78 | CNR1 (0.44) | CYP2C19HIF1ACYP1A2MAPTKMT2A | |
| SCHEMBL462801 | 0.78 | CYP2C19 (0.48) | MIFCYP2C19HIF1AKIF11MAPT | |
| SCHEMBL3703335 | 0.78 | CYP2C19 (0.53) | CYP2C19HIF1ACYP1A2KIF11MAPT | |
| SCHEMBL14980287 | 0.77 | CYP2C19 (0.52) | MIFCYP2C19HIF1ACYP1A2KIF11 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1047411-B1 | SUBSTITUTED DIPHENYL INDANONE, INDANE AND INDOLE COMPOUNDS AND ANALOGUES THEREOF USEFUL FOR THE TREATMENT OR PREVENTION OF DISEASES CHARACTERIZED BY ABNORMAL CELL PROLIFERATION | HARVARD COLLEGE (US) | 2004-02-11 | — | — | EP | disclosed |
| US-5874436-A | EFFECTIVE IN INHIBITING THE ACTION OF A BACTERIAL HISTIDINE PROTEIN KINASE; USEFUL AGAINST ANTIBIOTIC RESISTANT ORGANISMS | DEMERS JAMES P (US) | 1999-02-23 | — | — | US | disclosed |
| WO-1997048676-A1 | TRIPHENYLALKYL ANTIMICROBIAL AGENTS | ORTHO PHARMACEUTICAL CORPORATION (US) | 1997-12-24 | — | — | WO | disclosed |
| US-5643950-A | INHIBITORS OF A BACTERIAL HISTIDINE PROTEIN KINASE | ORTHO PHARMACEUTICAL CORPORATION (US) | 1997-07-01 | — | — | US | disclosed |
| US-4086227-A | Novel anti-diarrheal 4-azatricyclo[4.3.1.13,8 ] undecane derivatives | G. D. SEARLE & CO. (US) | 1978-04-25 | — | — | US | disclosed |
| US-4072686-A | ANTIDIARRHEAL | G. D. SEARLE & CO. (US) | 1978-02-07 | — | — | US | disclosed |
| US-4057549-A | Triarylpropyl-azabicyclooctanes | G. D. SEARLE & CO. (US) | 1977-11-08 | — | — | US | disclosed |
| US-3998832-A | ANTI-DIARRHEAL COMPOUNDS | G. D. SEARLE & CO. (US) | 1976-12-21 | — | — | US | disclosed |