Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.69 |
| ▸ | TSHR | P16473 | 7/20 | 0.69 |
| ▸ | LMNA | P02545 | 2/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.66 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.66 |
| ▸ | TP53 | P04637 | 1/20 | 0.66 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.62 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | RELA | Q04206 | 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 | |
|---|---|---|---|---|
| SCHEMBL11653034 | 0.98 | TSHR (0.68) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL29226917 | 0.92 | TSHR (0.67) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL28829560 | 0.92 | ALDH1A1 (0.84) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL30885020 | 0.86 | TSHR (0.59) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL28098 | 0.85 | ALDH1A1 (0.69) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL11310332 | 0.85 | ALDH1A1 (0.51) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL6517486 | 0.84 | ALDH1A1 (0.64) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL14673012 | 0.84 | TDP1 (0.79) | ALDH1A1TSHRLMNAMAPK1TDP1 | |
| SCHEMBL14673582 | 0.84 | TDP1 (0.79) | ALDH1A1TSHRLMNAMAPK1TDP1 | |
| SCHEMBL11741530 | 0.84 | TDP1 (0.79) | ALDH1A1TSHRLMNAMAPK1TDP1 |
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-4094850-A | POLYOLEFIN, HALOGENATED CARBOXYLIC ESTERS AS PLASTICIZER | MONSANTO COMPANY (US) | 1978-06-13 | — | — | US | claimed |
| US-4094850-A | POLYOLEFIN, HALOGENATED CARBOXYLIC ESTERS AS PLASTICIZER | MONSANTO COMPANY (US) | 1978-06-13 | — | — | US | disclosed |