Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 4/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 2/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.47 |
| ▸ | CNR1 | P21554 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 1/20 | 0.47 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.47 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.47 |
| ▸ | GCGR | P47871 | 1/20 | 0.47 |
| ▸ | DRD1 | P21728 | 1/20 | 0.46 |
| ▸ | DRD4 | P21917 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Ethylbenzene SCHEMBL7106162 | 0.93 | LTA4H (0.61) | LTA4HKDM4EMAPTKMT2ANPC1 | |
| SCHEMBL9940347 | 0.90 | LTA4H (0.61) | LTA4HKDM4EMAPTESR1ESR2 | |
| SCHEMBL9940230 | 0.89 | LTA4H (0.62) | LTA4HKDM4EMAPTESR1ESR2 | |
| SCHEMBL9966911 | 0.89 | LTA4H (0.62) | LTA4HKDM4EMAPTESR1ESR2 | |
| SCHEMBL9966913 | 0.88 | LTA4H (0.62) | LTA4HKMT2AESR1ESR2PSMB1 | |
| SCHEMBL9966811 | 0.87 | ESR1 (0.62) | LTA4HCA12CA1CA2CA7 | |
| SCHEMBL9967009 | 0.85 | LTA4H (0.58) | LTA4HKDM4ENPC1RAB9AESR1 | |
| SCHEMBL9966912 | 0.85 | KDM4E (0.53) | LTA4HKDM4E | |
| SCHEMBL9940254 | 0.85 | LTA4H (0.57) | LTA4HNPC1RAB9AESR1ESR2 | |
| SCHEMBL28727062 | 0.84 | KDM4E (0.60) | KDM4EMAPTKMT2ANPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012079154-A1 | SELECTIVE ESTROGEN RECEPTOR MODULATORS | DALHOUSIE UNIVERSITY (CA) | 2012-06-21 | — | — | WO | disclosed |
| WO-2012079154-A1 | SELECTIVE ESTROGEN RECEPTOR MODULATORS | DALHOUSIE UNIVERSITY (CA) | 2012-06-21 | — | — | WO | disclosed |