Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.70 |
| ▸ | LMNA | P02545 | 3/20 | 0.70 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | SLC22A1 | O15245 | 2/20 | 0.38 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | RAD52 | P43351 | 1/20 | 0.36 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.36 |
| ▸ | DNM1 | Q05193 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Pentane SCHEMBL263747 | 1.00 | — | — | |
| Pentane SCHEMBL4347896 | 1.00 | TSHR (0.70) | TSHRLMNATDP1ALDH1A1THRB | |
| Pentane SCHEMBL8737322 | 1.00 | TSHR (0.70) | TSHRLMNATDP1ALDH1A1THRB | |
| Pentane SCHEMBL9426357 | 0.95 | TSHR (0.64) | TSHRLMNATDP1ALDH1A1THRB | |
| Pentane SCHEMBL4359518 | 0.95 | TSHR (0.64) | TSHRLMNATDP1ALDH1A1THRB | |
| Pentane SCHEMBL8531440 | 0.95 | — | — | |
| Pentane SCHEMBL2454203 | 0.91 | TSHR (0.58) | TSHRLMNATDP1ALDH1A1THRB | |
| Hexane SCHEMBL19547603 | 0.90 | TSHR (0.64) | TSHRLMNATDP1ALDH1A1THRB | |
| Hexane SCHEMBL7176518 | 0.90 | TSHR (0.64) | TSHRLMNATDP1ALDH1A1THRB | |
| Hexane SCHEMBL6552198 | 0.90 | TSHR (0.64) | TSHRLMNATDP1ALDH1A1THRB |
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-20120277342-A1 | METHACRYLATE-BASED BULKY SIDE-CHAIN SILOXANE CROSS LINKERS FOR OPTICAL MEDICAL DEVICES | MCGEE JOSEPH A (US) | 2012-11-01 | — | — | US | disclosed |
| US-8246168-B2 | Methacrylate-based bulky side-chain siloxane cross linkers for optical medical devices | BAUSCH & LOMB INCORPORATED (US) | 2012-08-21 | — | — | US | disclosed |
| US-20100118261-A1 | METHACRYLATE-BASED BULKY SIDE-CHAIN SILOXANE CROSS LINKERS FOR OPTICAL MEDICAL DEVICES | VRX HOLDCO LLC | 2010-05-13 | — | — | US | disclosed |