Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL11232780 | 0.81 | ALDH1A1 (0.39) | ALDH1A1TDP1TSHRLMNACYP3A4 | |
| SCHEMBL10639638 | 0.78 | ALDH1A1 (0.31) | ALDH1A1TDP1LMNACYP3A4 | |
| SCHEMBL10639634 | 0.78 | ALDH1A1 (0.31) | ALDH1A1TDP1LMNACYP3A4 | |
| SCHEMBL984967 | 0.76 | TSHR (0.46) | ALDH1A1TDP1TSHRLMNA | |
| SCHEMBL31214626 | 0.75 | TSHR (0.58) | ALDH1A1TSHRLMNA | |
| SCHEMBL10967647 | 0.74 | CYP3A4 (0.41) | ALDH1A1TDP1TSHRLMNACYP3A4 | |
| SCHEMBL10967643 | 0.74 | CYP3A4 (0.41) | ALDH1A1TDP1TSHRLMNACYP3A4 | |
| SCHEMBL7876257 | 0.74 | ALDH1A1 (0.41) | ALDH1A1TDP1TSHR | |
| SCHEMBL7808732 | 0.74 | — | — | |
| SCHEMBL9609529 | 0.73 | ALDH1A1 (0.41) | ALDH1A1TDP1LMNACYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0030109-B1 | PROCESS FOR PRODUCING ISOPRENE | KURARAY CO., LTD. (JP) | 1983-10-05 | — | — | EP | disclosed |
| US-4381416-A | Process for producing isoprene | KURARAY CO., LTD. (JP) | 1983-04-26 | — | — | US | disclosed |
| EP-0030109-A1 | Process for producing isoprene | KURARAY CO., LTD. (JP) | 1981-06-10 | — | — | EP | disclosed |