Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.65 |
| ▸ | LMNA | P02545 | 1/20 | 0.65 |
| ▸ | ALB | P02768 | 1/20 | 0.65 |
| ▸ | POLB | P06746 | 1/20 | 0.65 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.65 |
| ▸ | BLM | P54132 | 1/20 | 0.65 |
| ▸ | TYMP | P19971 | 5/20 | 0.62 |
| ▸ | TK1 | P04183 | 1/20 | 0.54 |
| ▸ | TK2 | O00142 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL19224110 | 0.96 | ALDH1A1 (0.64) | ALDH1A1LMNAALBPOLBADRA1A | |
| SCHEMBL1374887 | 0.91 | TK2 (0.59) | ALDH1A1LMNAALBPOLBADRA1A | |
| SCHEMBL1071349 | 0.91 | TK2 (0.59) | ALDH1A1LMNAALBPOLBADRA1A | |
| SCHEMBL26090044 | 0.91 | TK2 (0.59) | ALDH1A1LMNAALBPOLBADRA1A | |
| SCHEMBL16904870 | 0.91 | ALDH1A1 (0.61) | ALDH1A1LMNAALBPOLBADRA1A | |
| SCHEMBL19224122 | 0.91 | TK2 (0.59) | ALDH1A1LMNAALBPOLBADRA1A | |
| SCHEMBL10008489 | 0.91 | TK2 (0.59) | ALDH1A1LMNAALBPOLBADRA1A | |
| SCHEMBL4463388 | 0.91 | TK2 (0.59) | ALDH1A1LMNAALBPOLBADRA1A | |
| SCHEMBL12170436 | 0.91 | TK2 (0.59) | ALDH1A1LMNAALBPOLBADRA1A | |
| SCHEMBL26268051 | 0.90 | ALDH1A1 (0.60) | ALDH1A1LMNAALBPOLBADRA1A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5597824-A | VIRICIDES | ABBOTT LABORATORIES (US) | 1997-01-28 | — | — | US | disclosed |
| US-5420276-A | Ring contraction via diazoketone intermediate, active against herpes | ABBOTT LABORATORIES (US) | 1995-05-30 | — | — | US | disclosed |
| EP-0433898-A2 | Analogs of oxetanyl purines and pyrimidines | ABBOTT LABORATORIES (US) | 1991-06-26 | — | — | EP | disclosed |