Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PON1 | P27169 | 1/20 | 0.61 |
| ▸ | PIM1 | P11309 | 1/20 | 0.58 |
| ▸ | CA9 | Q16790 | 3/20 | 0.54 |
| ▸ | CA12 | O43570 | 2/20 | 0.54 |
| ▸ | CA1 | P00915 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL18400830 | 0.87 | ALDH1A1 (0.62) | PON1PIM1CA9CA12CA1 | |
| SCHEMBL8071986 | 0.81 | PON1 (0.63) | PON1CA9CA12CA1ALDH1A1 | |
| SCHEMBL2490464 | 0.77 | PIM1 (0.64) | PIM1CA9CA12CA1ALDH1A1 | |
| SCHEMBL31290722 | 0.77 | PIM1 (0.64) | PIM1CA9CA12CA1ALDH1A1 | |
| SCHEMBL5341818 | 0.77 | KDM4E (0.72) | PIM1CA9CA12CA1ALDH1A1 | |
| SCHEMBL12181810 | 0.77 | PON1 (0.57) | PON1ALDH1A1MAPTKMT2AKDM4E | |
| SCHEMBL8107352 | 0.77 | PIM1 (0.58) | PIM1CA9CA12CA1ALDH1A1 | |
| SCHEMBL23056731 | 0.76 | PON1 (0.54) | PON1ALDH1A1MAPTKMT2AKDM4E | |
| SCHEMBL20110024 | 0.74 | LMNA (0.48) | PON1ALDH1A1MAPTKMT2AKDM4E | |
| SCHEMBL2761544 | 0.74 | PIM1 (1.00) | PIM1CA9CA12CA1ALDH1A1 |
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-5968940-A | CONTAINING A PURINE DERIVATIVE; ANTICARCINOGENIC AGENTS | INSTITUTE OF MATERIA MEDICA (CN) | 1999-10-19 | — | — | US | disclosed |
| EP-0850233-A1 | RETINOIDS AND METHODS OF USE OF SAME | THE INSTITUTE OF MATERIA MEDICA OF CHINESE ACADEMY OF MEDICAL SCIENCES (CN) | 1998-07-01 | — | — | EP | disclosed |
| WO-1996040669-A1 | RETINOIDS AND METHODS OF USE OF SAME | INSTITUTE OF MATERIA MEDICA, an Institute of the C (CN) | 1996-12-19 | — | — | WO | disclosed |
| US-3993670-A | OPTICAL BRIGHTENERS | BAYER AKTIENGESELLSCHAFT (DT) | 1976-11-23 | — | — | US | disclosed |
| US-3971731-A | OPTICAL BRIGHTENER, UV ABSORBER | BAYER AKTIENGESELLSCHAFT (DT) | 1976-07-27 | — | — | US | disclosed |
| US-3968119-A | OPTICAL BRIGHTENERS | BAYER AKTIENGESELLSCHAFT (DT) | 1976-07-06 | — | — | US | disclosed |