Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 4/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 9/20 | 0.38 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.38 |
| ▸ | ABAT | P80404 | 1/20 | 0.38 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ESR1 | P03372 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | GMNN | O75496 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CA3 | P07451 | 1/20 | 0.33 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3901979 | 0.81 | HTR2A (0.46) | HSD17B10 | |
| SCHEMBL2360390 | 0.79 | KDM1A (0.52) | KDM1A | |
| SCHEMBL2854689 | 0.79 | KDM1A (0.52) | KDM1AMEN1KMT2ANPC1CYP2C9 | |
| SCHEMBL7797793 | 0.79 | DDB1 (0.37) | KDM1AMEN1KMT2AALDH1A1MAPT | |
| SCHEMBL11965121 | 0.79 | HTR2A (0.44) | ALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL2324658 | 0.79 | KDM1A (0.52) | KDM1AMEN1KMT2ANPC1CYP2C9 | |
| SCHEMBL2359931 | 0.79 | HTR2A (0.44) | ALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL2827719 | 0.79 | KDM1A (0.52) | KDM1AMEN1KMT2ANPC1CYP2C9 | |
| SCHEMBL26455980 | 0.79 | TSHR (0.44) | KDM1AKMT2AALDH1A1CA12CA1 | |
| SCHEMBL18567234 | 0.78 | MAOB (0.48) | KDM1AKDM4ECYP3A4MAPTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-7462713-B2 | Tricyclic compounds protein kinase inhibitors for enhancing the efficacy of anti-neoplastic agents and radiation therapy | AGOURON PHARMACEUTICALS, INC. (US) | 2008-12-09 | — | — | US | disclosed |
| WO-2005051904-A2 | NOVEL PROCESSES FOR THE SYNTHESIS OF CYCLOPROPYL COMPOUNDS | PHARMACIA CORPORATION (US) | 2005-06-09 | — | — | WO | disclosed |