Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.58 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | APEX1 | P27695 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.45 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.45 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | GGT1 | P19440 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9127984 | 0.86 | ALDH1A1 (0.42) | ALDH1A1KMT2APTK2BKDM4EHTT | |
| SCHEMBL6041508 | 0.86 | ALDH1A1 (0.51) | ALDH1A1KMT2AKDM4EHTTLMNA | |
| SCHEMBL7083354 | 0.83 | KDM4E (0.52) | ALDH1A1KMT2APTK2BKDM4EHTT | |
| SCHEMBL2451818 | 0.83 | ALDH1A1 (0.63) | ALDH1A1KMT2APTK2BKDM4EHTT | |
| SCHEMBL8574650 | 0.82 | HCRTR1 (0.45) | ALDH1A1KDM4ELMNASMN1; SMN2TSHR | |
| SCHEMBL8945690 | 0.82 | ALDH1A1 (0.66) | ALDH1A1KMT2APTK2BKDM4EHTT | |
| SCHEMBL9051307 | 0.82 | ALDH1A1 (0.39) | ALDH1A1KMT2APTK2BKDM4EAPEX1 | |
| SCHEMBL4911189 | 0.80 | AKR1C3 (0.49) | ALDH1A1KMT2ALMNASMN1; SMN2HSD17B10 | |
| SCHEMBL29444034 | 0.79 | ALDH1A1 (0.69) | ALDH1A1KMT2APTK2BKDM4EHTT | |
| SCHEMBL633198 | 0.79 | ALDH1A1 (0.69) | ALDH1A1KMT2APTK2BKDM4EHTT |
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-5849750-A | Dynemicin analogs | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 1998-12-15 | — | — | US | disclosed |
| US-5763451-A | Dynemicin analogs | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 1998-06-09 | — | — | US | disclosed |