Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 14/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 8/20 | 0.61 |
| ▸ | TSHR | P16473 | 5/20 | 0.60 |
| ▸ | CFTR | P13569 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Isobutyl 2-Aminobenzoate SCHEMBL1532440 | 0.89 | ALDH1A1 (0.77) | ALDH1A1HSD17B10TSHRCFTRKDM4E | |
| SCHEMBL8546366 | 0.84 | ALDH1A1 (0.60) | ALDH1A1HSD17B10TSHRCFTRKDM4E | |
| SCHEMBL17797889 | 0.83 | ALDH1A1 (0.62) | ALDH1A1HSD17B10TSHRKDM4ESMN1; SMN2 | |
| SCHEMBL12083362 | 0.83 | ALDH1A1 (0.62) | ALDH1A1HSD17B10TSHRKDM4ERAB9A | |
| SCHEMBL7866508 | 0.82 | ALDH1A1 (0.51) | ALDH1A1HSD17B10TSHRCFTRKDM4E | |
| SCHEMBL28280177 | 0.81 | ALDH1A1 (0.57) | ALDH1A1HSD17B10TSHRCFTRKDM4E | |
| SCHEMBL28078429 | 0.81 | ALDH1A1 (0.53) | ALDH1A1HSD17B10TSHRCFTRKDM4E | |
| SCHEMBL3090269 | 0.81 | ALDH1A1 (0.55) | ALDH1A1HSD17B10TSHRCFTRKDM4E | |
| SCHEMBL11023805 | 0.81 | ALDH1A1 (0.66) | ALDH1A1HSD17B10TSHRCFTRKDM4E | |
| SCHEMBL1783465 | 0.81 | ALDH1A1 (0.60) | ALDH1A1TSHRRAB9ASMN1; SMN2HPGD |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6401724-B1 | POLYUREA-FORMING COMPOSITION SUCH AS 1)AN AMINOBENZOIC ACID ESTER OR AMIDE OF A POSSIBLY OLIGOMERIC POLYOL OR POLYAMINE OR AN AROMATIC DIAMINE AND 2)A POLYISOCYANATE | PAR PHARMACEUTICALS INCORPORATED | 2002-06-11 | — | — | US | disclosed |
| US-6403063-B1 | APPLYING POLYUREA; CURING | SAWYER KENNETH I (US) | 2002-06-11 | — | — | US | disclosed |
| EP-0538850-B1 | New polyurea resins and their preparation and use | IHARA CHEMICAL IND CO (JP) | 1997-01-22 | — | — | EP | disclosed |
| US-5319058-A | Improved heat resistance when polyisocyanate component is a combination of an aliphatic diisocyanate and a cyclic trimer of an aliphatic polyisocyanate | IHARA CHEMICAL INDUSTRY CO., LTD. (JP) | 1994-06-07 | — | — | US | disclosed |
| EP-0538850-A2 | New polyurea resins and their preparation and use | IHARA CHEMICAL INDUSTRY Co., Ltd. (JP) | 1993-04-28 | — | — | EP | disclosed |